1,2,2,5,5-Pentamethyl-2,5-dihydro-1H-imidazole 3-oxide 1,2,2,5,5-pentamethyl-2,5-dihydro-1H-imidazole 3-oxide 1H-imidazole, 2,5-dihydro-1,2,2,5,5-pentamethyl-, 3-oxide InChI=1/C8H16N2O/c1-7(2)6-10(11)8(3,4)9(7)5/h6H,1-5H3 UNPSXBKCCZEIRN-UHFFFAOYAC 1,2,2,5,5-Pentamethyl-3-imidazoline 3-oxide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 2-hydroxy-5-isopropenyl-1-isopropyl-4-methyl-4-vinyl-cyclohexyl ester (1R,2R,4R,5R)-2-hydroxy-5-isopropenyl-1-isopropyl-4-methyl-4-vinylcyclohexyl rel-acetate 1,2-cyclohexanediol, 4-ethenyl-4-methyl-5-(1-methylethenyl)-1-(1-methylethyl)-, 1-acetate, (1R,2R,4R,5R)- InChI=1/C17H28O3/c1-8-16(7)10-15(19)17(12(4)5,20-13(6)18)9-14(16)11(2)3/h8,12,14-15,19H,1-2,9-10H2,3-7H3/t14-,15-,16+,17-/m1/s1 MAEYHNLIMUMZET-WCXIOVBPBH (+)-(1R,2R,4R,5R)-4-Ethenyl-2-hydroxy-4-methyl-5-(1-methylethenyl)-1-(1-methylethyl)-cyclohexylacetate (+)-7-Acetoxy-elema-1,3-dien-8-ol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1,3a,6-Trimethyl-1,3a,4,5,5a,6,7,8-octahydro-cyclopenta[c]pentalen-2-yl)-methanol rel-[(1R,3aS,5aS,6R,8aR)-1,3a,6-trimethyl-1,3a,4,5,5a,6,7,8-octahydrocyclopenta[c]pentalen-2-yl]methanol cyclopenta[c]pentalene-2-methanol, 1,3a,4,5,5a,6,7,8-octahydro-1,3a,6-trimethyl-, (1S,3aR,5aR,8aS)- InChI=1/C15H24O/c1-10-4-7-15-11(2)12(9-16)8-14(15,3)6-5-13(10)15/h8,10-11,13,16H,4-7,9H2,1-3H3/t10-,11+,13+,14+,15+/m0/s1 GJNXTRPTZOVADS-PWRGDLIEBU Subergorgiol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-({2,4-dihydroxy-3-methyl-6-[(1E)-1-methylprop-1-en-1-yl]benzoyl}oxy)-2-hydroxy-3-methyl-6-[(1E)-1-methylprop-1-en-1-yl]benzoic acid benzoic acid, 4-[[2,4-dihydroxy-3-methyl-6-[(1E)-1-methyl-1-propenyl]benzoyl]oxy]-2-hydroxy-3-methyl-6-[(1E)-1-methyl-1-propenyl]- InChI=1/C24H26O7/c1-7-11(3)15-9-17(25)13(5)21(26)20(15)24(30)31-18-10-16(12(4)8-2)19(23(28)29)22(27)14(18)6/h7-10,25-27H,1-6H3,(H,28,29)/b11-7+,12-8+ LFTHRDXERPBJOF-MKICQXMIBH Agonodepside B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Hydroxy-3-methyl-pentanoic acid 4,8-dimethyl-12-methylene-13-oxo-3,14-dioxa-tricyclo[9.3.0.02,4]tetradec-7-en-9-yl ester (1aR,4E,6S,7aR,10aS,10bS)-1a,5-dimethyl-8-methylene-9-oxo-1a,2,3,6,7,7a,8,9,10a,10b-decahydrooxireno[9,10]cyclodeca[1,2-b]furan-6-yl rel-3-hydroxy-3-methylpentanoate pentanoic acid, 3-hydroxy-3-methyl-, (1aS,4E,6R,7aS,10aR,10bR)-1a,2,3,6,7,7a,8,9,10a,10b-decahydro-1a,5-dimethyl-8-methylene-9-oxooxireno[9,10]cyclodeca[1,2-b]furan-6-yl ester InChI=1/C21H30O6/c1-6-20(4,24)11-16(22)25-15-10-14-13(3)19(23)26-17(14)18-21(5,27-18)9-7-8-12(15)2/h8,14-15,17-18,24H,3,6-7,9-11H2,1-2,4-5H3/b12-8+/t14-,15?,17+,18+,20?,21-/m0/s1 NXPRFOOHJTWPQI-UQDPOFOMBM 9β-(3-Hydroxy-3-methylpentanoyloxy)parthenolide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-amino-3-(butane-1-sulfinyl)-propionic acid 3-(butylsulfinyl)alanine L-alanine, 3-(butylsulfinyl)- InChI=1/C7H15NO3S/c1-2-3-4-12(11)5-6(8)7(9)10/h6H,2-5,8H2,1H3,(H,9,10)/t6-,12?/m0/s1 CBFHOPPJBYHALQ-RLWMBFFFBF S-n-Butylcysteine sulfoxide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
[2-(3,4-Dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yloxy)-6-hydroxy-4-methoxy-phenyl]-(3,5-dihydroxy-phenyl)-methanone 2-(3,5-dihydroxybenzoyl)-3-hydroxy-5-methoxyphenyl arabinofuranoside methanone, [2-(L-arabinofuranosyloxy)-6-hydroxy-4-methoxyphenyl](3,5-dihydroxyphenyl)- InChI=1/C19H20O10/c1-27-11-5-12(23)15(16(24)8-2-9(21)4-10(22)3-8)13(6-11)28-19-18(26)17(25)14(7-20)29-19/h2-6,14,17-23,25-26H,7H2,1H3/t14-,17-,18+,19?/m0/s1 DLVIWTXNNUETST-DYJHLDHHBY 2-O-α-L-arabinofuranosyl-3',5',6-trihydroxy-4-methoxybenzophenone Annulatophenonoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-methoxy-3H-naphtho[2,1,8-mna]xanthen-3-one 3H-naphtho[2,1,8-mna]xanthen-3-one, 5-methoxy- InChI=1/C20H12O3/c1-22-17-10-14-15(21)9-7-11-6-8-13-12-4-2-3-5-16(12)23-20(17)19(13)18(11)14/h2-10H,1H3 NMULBEGPQLUQPJ-UHFFFAOYAW 5-Methoxy-6-oxa-benzo[def]chrysen-3-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,1,4,7-tetramethyl-1a,5,6,7,7a,7b-hexahydro-1H,2H-cyclopropa[e]azulen-3-one rel-(1aR,7R,7aS,7bR)-1,1,4,7-tetramethyl-1,1a,2,5,6,7,7a,7b-octahydro-3H-cyclopropa[e]azulen-3-one 3H-cycloprop[e]azulen-3-one, 1,1a,2,5,6,7,7a,7b-octahydro-1,1,4,7-tetramethyl-, (1aR,7R,7aS,7bR)- InChI=1/C15H22O/c1-8-5-6-10-9(2)12(16)7-11-14(13(8)10)15(11,3)4/h8,11,13-14H,5-7H2,1-4H3/t8-,11-,13-,14-/m1/s1 FUIPJCVSKAWFTI-KLPZLMTLBE Aromadendr-1(10)-en-9-one Squamulosone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,3-Diphenyl-3,11-dihydro-4-oxa-11-aza-benzo[a]fluorene 3,3-diphenyl-3,11-dihydropyrano[3,2-a]carbazole pyrano[3,2-a]carbazole, 3,11-dihydro-3,3-diphenyl- InChI=1/C27H19NO/c1-3-9-19(10-4-1)27(20-11-5-2-6-12-20)18-17-23-25(29-27)16-15-22-21-13-7-8-14-24(21)28-26(22)23/h1-18,28H NQHLEDVYHAMMOS-UHFFFAOYAP 3,11-Dihydro-3,3-diphenylpyrano[3,2-a]carbazole . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-[2-Hydroxy-4,5-di-p-tolyl-2-(2-p-tolyl-vinyl)-cyclopentyl]-3-p-tolyl-propenone (2E)-1-{2-hydroxy-4,5-bis(4-methylphenyl)-2-[(E)-2-(4-methylphenyl)vinyl]cyclopentyl}-3-(4-methylphenyl)prop-2-en-1-one (non-preferred name) InChI=1/C38H38O2/c1-26-5-13-30(14-6-26)17-22-35(39)37-36(33-20-11-29(4)12-21-33)34(32-18-9-28(3)10-19-32)25-38(37,40)24-23-31-15-7-27(2)8-16-31/h5-24,34,36-37,40H,25H2,1-4H3/b22-17+,24-23+ AMATXVWHBUHGMW-RWMXDCAABZ 1-[2-Hydroxy-4,5-di-p-tolyl-2-(2-p-tolyl-vinyl)-cyclopentyl]-3-p-tolyl-propenone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-[5-(2-Carboxy-ethyl)-2-thioxo-[1,3,5]thiadiazinan-3-yl]-hexanoic acid 6-[5-(2-carboxyethyl)-2-thioxo-1,3,5-thiadiazinan-3-yl]hexanoic acid 2H-1,3,5-thiadiazine-3(4H)-hexanoic acid, 5-(2-carboxyethyl)dihydro-2-thioxo- InChI=1/C12H20N2O4S2/c15-10(16)4-2-1-3-6-14-8-13(7-5-11(17)18)9-20-12(14)19/h1-9H2,(H,15,16)(H,17,18) STFRAXMYNUOXIZ-UHFFFAOYAS 6-[5-(2-Carboxy-ethyl)-2-thioxo-[1,3,5]thiadiazinan-3-yl]-hexanoic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(5-Furan-2-ylmethyl-6-thioxo-[1,3,5]thiadiazinan-3-yl)-acetic acid [5-(2-furylmethyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]acetic acid 2H-1,3,5-thiadiazine-3(4H)-acetic acid, 5-(2-furanylmethyl)dihydro-6-thioxo- InChI=1/C10H12N2O3S2/c13-9(14)5-11-6-12(10(16)17-7-11)4-8-2-1-3-15-8/h1-3H,4-7H2,(H,13,14) PLUJRJNZXXCCSS-UHFFFAOYAC (5-Furan-2-ylmethyl-6-thioxo-[1,3,5]thiadiazinan-3-yl)-acetic acid . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
methyl rel-(2beta,3beta,4beta,5alpha,12beta,19alpha)-4-(acetyloxy)-15-[(6R,8S)-4-(1,1-difluoroethyl)-8-(methoxycarbonyl)-1,3,4,5,6,7,8,9-octahydro-2,6-methanoazecino[4,3-b]indol-8-yl]-3-hydroxy-16-met aspidospermidine-3-carboxylic acid, 4-(acetyloxy)-6,7-didehydro-15-[(6R,8S)-4-(1,1-difluoroethyl)-1,3,4,5,6,7,8,9-octahydro-8-(methoxycarbonyl)-2,6-methano-2H-azecino[4,3-b]indol-8-yl]-3-hydroxy-16-me InChI=1/C45H54F2N4O8/c1-8-42-14-11-16-51-17-15-43(36(42)51)30-19-31(34(56-5)20-33(30)49(4)37(43)45(55,40(54)58-7)38(42)59-25(2)52)44(39(53)57-6)21-26-18-27(41(3,46)47)23-50(22-26)24-29-28-12-9-10-13-32(28)48-35(29)44/h9-14,19-20,26-27,36-38,48,55H,8,15-1 NMDYYWFGPIMTKO-BUQAPDNUBL 20',20'-difluoro-3',4'-dihydrovinorelbine vinflunine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(4-carboxy-phenyl)-6-chloro-5-formyl-2-methyl-1,4-dihydro-pyridine-3-carboxylic acid methyl ester 4-[2-chloro-3-formyl-5-(methoxycarbonyl)-6-methyl-1,4-dihydropyridin-4-yl]benzoic acid 3-pyridinecarboxylic acid, 4-(4-carboxyphenyl)-6-chloro-5-formyl-1,4-dihydro-2-methyl-, 3-methyl ester InChI=1/C16H14ClNO5/c1-8-12(16(22)23-2)13(11(7-19)14(17)18-8)9-3-5-10(6-4-9)15(20)21/h3-7,13,18H,1-2H3,(H,20,21) OTDBKLKJDNTCDP-UHFFFAOYAF Methyl 4-(4-carboxyphenyl)-6-chloro-5-formyl-2-methyl-1,4-dihydropyridine-3-carboxylate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6,7-Dihydroxy-5-hydroxymethyl-3-(2-hydroxy-phenyl)-hexahydro-pyrano[2,3-d]oxazol-2-one 6,7-dihydroxy-5-(hydroxymethyl)-3-(2-hydroxyphenyl)hexahydro-2H-pyrano[2,3-d][1,3]oxazol-2-one 2H-pyrano[2,3-d]oxazol-2-one, hexahydro-6,7-dihydroxy-5-(hydroxymethyl)-3-(2-hydroxyphenyl)- InChI=1/C13H15NO7/c15-5-8-9(17)10(18)11-12(20-8)14(13(19)21-11)6-3-1-2-4-7(6)16/h1-4,8-12,15-18H,5H2 XBYMZYWXQBJAJG-UHFFFAOYAM 1-(2-Hydroxyphenylamino)-1-deoxy-β-glucopyranoside 1,2-carbamate 1-(2-Hydroxyphenylamino)-1-deoxy-β-glucoside 1,2-carbamate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,8-Dibromo-4-chloro-4,11,12,12-tetramethyl-7-oxa-tricyclo[6.3.1.0^(1,6)]dodec-9-en-11-ol rel-(2R,5R,5aR,7S)-2,7-dibromo-8-chloro-5,8,10,10-tetramethyl-2,5,7,8,9,9a-hexahydro-6H-2,5a-methano-1-benzoxepin-5-ol 6H-2,5a-methano-1-benzoxepin-5-ol, 2,7-dibromo-8-chloro-2,5,7,8,9,9a-hexahydro-5,8,10,10-tetramethyl-, (2R,5R,5aR,7S)- InChI=1/C15H21Br2ClO2/c1-11(2)14-7-9(16)12(3,18)8-10(14)20-15(11,17)6-5-13(14,4)19/h5-6,9-10,19H,7-8H2,1-4H3/t9-,10?,12?,13+,14-,15?/m0/s1 WNGMEQXERFPHIP-FHCFRXRVBO Pacifenol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(3aR,5R,5'R,6aR,7S,8S,10S,10aS)-5'-(3-furyl)-5-hydroxy-8-methyloctahydro-8H-spiro[3a,10-epoxynaphtho[1,8a-c]furan-7,3'-furan]-2',3-dione bicyclo[3.3.1]non-3-ene-2,9-dione, 3-benzoyl-4-hydroxy-8,8-dimethyl-1,5,7-tris(3-methyl-2-butenyl)-, (5R,7S)- InChI=1/C20H22O7/c1-10-4-15-19-9-25-17(23)20(19,27-15)6-12(21)5-14(19)18(10)7-13(26-16(18)22)11-2-3-24-8-11/h2-3,8,10,12-15,21H,4-7,9H2,1H3/t10-,12+,13+,14-,15-,18-,19+,20-/m1/s1 NSCSTGLJZSMRIY-RWZNVSPQBN Chamaedroxide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Benzoyl-4-hydroxy-8,8-dimethyl-1,5,7-tris-(3-methyl-but-2-enyl)-bicyclo[3.3.1]non-3-ene-2,9-dione rel-(5R,7S)-3-benzoyl-4-hydroxy-8,8-dimethyl-1,5,7-tris(3-methylbut-2-en-1-yl)bicyclo[3.3.1]non-3-ene-2,9-dione bicyclo[3.3.1]non-3-ene-2,9-dione, 3-benzoyl-4-hydroxy-8,8-dimethyl-1,5,7-tris(3-methyl-2-butenyl)-, (1S,5S,7S)- InChI=1/C33H42O4/c1-21(2)14-15-25-20-32(18-16-22(3)4)28(35)26(27(34)24-12-10-9-11-13-24)29(36)33(30(32)37,31(25,7)8)19-17-23(5)6/h9-14,16-17,25,35H,15,18-20H2,1-8H3/t25-,32?,33?/m0/s1 JXKKYQPCNJMAHZ-RFQWPUQQBK 1-benzoyl-6-hydroxy-14,14-dimethyl-3,5,15-tri(3-methyl-2-butenyl)bicyclo[3.3.1]non-1-ene-2,4-dione 15-Epiclusianone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Amino-3-{5-[5-(2-amino-2-carboxy-ethyl)-1-methyl-1H-imidazol-4-yldisulfanyl]-3-methyl-3H-imidazol-4-yl}-propionic acid 3,3'-[dithiobis(1-methyl-1H-imidazole-4,5-diyl)]bis(2-aminopropanoic acid) (non-preferred name) 2H,12H-6,12a-epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-, methyl ester, (2S,3E,6S,12aR,12bS)- InChI=1/C14H20N6O4S2/c1-19-5-17-11(9(19)3-7(15)13(21)22)25-26-12-10(20(2)6-18-12)4-8(16)14(23)24/h5-8H,3-4,15-16H2,1-2H3,(H,21,22)(H,23,24) NRGVZXSKWPQYMK-UHFFFAOYAF Ovothiol A disulfide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
methyl (2alpha,5alpha,15alpha,16xi,19E)-1,2-dihydro-2,5-epoxyakuammilan-17-oate 2H,12H-6,12a-epoxy-2,7a-methanoindolo[2,3-a]quinolizine-14-carboxylic acid, 3-ethylidene-1,3,4,6,7,12b-hexahydro-, methyl ester, (2S,3E,6S,12aR,12bS)- InChI=1/C20H22N2O3/c1-3-11-10-22-15-8-12(11)17(18(23)24-2)19-9-16(22)25-20(15,19)21-14-7-5-4-6-13(14)19/h3-7,12,15-17,21H,8-10H2,1-2H3/b11-3-/t12-,15+,16+,17?,19?,20+/m1/s1 BDXYPHKGNUGUFG-PDHKNSLCBW Picrinin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
methyl rel-(10R,12R,13E,14S,17R)-13-ethylidene-17-hydroxy-16-oxa-8,15-diazahexacyclo[10.6.1.0~1,9~.0~2,7~.0~10,15~.0~14,18~]nonadeca-2,4,6,8-tetraene-19-carboxylate (non-preferred name) beta-D-glucopyranoside, 3,4,5-trimethoxyphenyl InChI=1/C20H20N2O4/c1-3-9-10-8-13-17-20(14(10)18(23)25-2,11-6-4-5-7-12(11)21-17)15-16(9)22(13)26-19(15)24/h3-7,10,13-16,19,24H,8H2,1-2H3/b9-3+/t10-,13+,14?,15?,16-,19+,20?/m1/s1 RTKCXWGAPBPXSB-RHQLWZJQBH Narelin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-hydroxymethyl-6-(3,4,5-trimethoxy-phenoxy)-tetrahydro-pyran-3,4,5-triol 3,4,5-trimethoxyphenyl beta-glucopyranoside beta-D-glucopyranoside, 3,4,5-trimethoxyphenyl InChI=1/C15H22O9/c1-20-8-4-7(5-9(21-2)14(8)22-3)23-15-13(19)12(18)11(17)10(6-16)24-15/h4-5,10-13,15-19H,6H2,1-3H3/t10-,11-,12+,13-,15-/m1/s1 NBLLRWANAFOKON-ZHZXCYKABC 3,4,5-Trimethoxyphenyl β-D-glucopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
[1,2,4]Triazolo[1,5-a]pyrimidine [1,2,4]triazolo[1,5-a]pyrimidine [1,2,4]triazolo[1,5-a]pyrimidine InChI=1/C5H4N4/c1-2-6-5-7-4-8-9(5)3-1/h1-4H SRNKZYRMFBGSGE-UHFFFAOYAR 1,2,4-triazolo[1,5-a]pyrimidine . Information we have got: NMR spectra 13C, 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-Isopropyl-1,6-dimethyl-1,2,3,4,4a,5,8,8a-octahydro-1,5-cyclo-naphthalene 8-isopropyl-1,3-dimethyltricyclo[4.4.0.0~2,7~]dec-3-ene tricyclo[4.4.0.0~2,7~]dec-3-ene, 1,3-dimethyl-8-(1-methylethyl)-, (8R)- InChI=1/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h5,9,11-14H,6-8H2,1-4H3/t11-,12?,13?,14?,15?/m1/s1 VLXDPFLIRFYIME-SHIHICALBU α-Copaene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-isopropenyl-1-methylcyclohexene cyclohexene, 1-methyl-4-(1-methylethenyl)- InChI=1/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3 XMGQYMWWDOXHJM-UHFFFAOYAC LIMONENE (D) . Information we have got: NMR spectra 13C, 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,6,10-Trimethyl-4,7,8,11-tetrahydro-cyclodeca[b]furan (5E)-3,6,10-trimethyl-4,7,8,11-tetrahydrocyclodeca[b]furan cyclodeca[b]furan, 4,7,8,11-tetrahydro-3,6,10-trimethyl-, (5E)- InChI=1/C15H20O/c1-11-5-4-6-12(2)9-15-14(8-7-11)13(3)10-16-15/h6-7,10H,4-5,8-9H2,1-3H3/b11-7+,12-6- VMDXHYHOJPKFEK-RZWYOFBOBY Furanodiene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4,7,7-Trimethyl-3-oxo-2-oxa-bicyclo[2.2.1]heptane-1-carboxylic acid (3H-naphtho[2,1-d]selenazol-2-ylidene)-amide rel-(1R,4S)-4,7,7-trimethyl-N-[(2Z)-naphtho[2,1-d][1,3]selenazol-2(3H)-ylidene]-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide 2-oxabicyclo[2.2.1]heptane-1-carboxamide, 4,7,7-trimethyl-N-[(2Z)-naphtho[2,1-d]selenazol-2(3H)-ylidene]-3-oxo-, (1S,4R)- InChI=1/C21H20N2O3Se/c1-19(2)20(3)10-11-21(19,26-17(20)25)16(24)23-18-22-14-9-8-12-6-4-5-7-13(12)15(14)27-18/h4-9H,10-11H2,1-3H3,(H,22,23,24)/t20-,21+/m0/s1 NTYPHZZBZGEEEI-LEWJYISDBR 2-[(1S,4R)-ω-Camphanoylimido]-naphtho[2,1-d]-1,3-selenazoline . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(2R,5S,7'R)-2,4',5',7,7',8-hexamethyl-2,7'-bis[(4R,8R)-4,8,12-trimethyltridecyl]-1',3,4,7',8',9'-hexahydrospiro[chromene-5,2'-furo[3,2-f]chromen]-6(2H)-one spiro[5H-1-benzopyran-5,2'-[2H]furo[3,2-f][1]benzopyran]-6(2H)-one, 1',3,4,7',8',9'-hexahydro-2,4',5',7,7',8-hexamethyl-2,7'-bis[(4R,8R)-4,8,12-trimethyltridecyl]-, (2R,5S,7'R)- InChI=1/C57H94O4/c1-38(2)21-15-23-40(5)25-17-27-42(7)29-19-33-55(13)35-31-48-49-37-57(61-52(49)45(10)44(9)51(48)59-55)50-32-36-56(14,60-53(50)46(11)47(12)54(57)58)34-20-30-43(8)28-18-26-41(6)24-16-22-39(3)4/h38-43H,15-37H2,1-14H3/t40-,41-,42-,43-,55-,56- RJOPHLJFFKIXDE-RITZJXLXBH (2R,5S,7'R)-2,4',5',7,7',8-Hexamethyl-2,7'-bis-[(4R,8R)-4,8,12-trimethyl-tridecyl]-1',2,3,4,6,7',8',9'-octahydrospiro[5H-1-benzopyran-5,2'-[2H]furo[3,2-f][1]benzopyran]-6-one . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
9-Hydroxy-6,6-dimethyl-3,6-dihydro-2,5-dioxa-cyclopenta[b]naphthalen-1-one 5-hydroxy-2,2-dimethyl-2,8-dihydro-6H-furo[3,4-g]chromen-6-one 6H-furo[3,4-g]-1-benzopyran-6-one, 2,8-dihydro-5-hydroxy-2,2-dimethyl- InChI=1/C13H12O4/c1-13(2)4-3-8-9(17-13)5-7-6-16-12(15)10(7)11(8)14/h3-5,14H,6H2,1-2H3 ZYOUEEMPKPNVQW-UHFFFAOYAM 5-Hydroxy-2,2-dimethyl-2,8-dihydro-6H-furo[3,4-g]chromen-6-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(2-Ethyl-6a-hydroxymethyl-2,4b,9,9,10b,12a-hexamethyl-octadecahydro-chrysen-1-yl)-propionic acid rel-3-[(2R,4bS,6aR,10bR,12aR)-2-ethyl-6a-(hydroxymethyl)-2,4b,9,9,10b,12a-hexamethyloctadecahydrochrysen-1-yl]propanoic acid 1-chrysenepropanoic acid, 2-ethyloctadecahydro-6a-(hydroxymethyl)-2,4b,9,9,10b,12a-hexamethyl-, (2S,4bR,6aS,10bS,12aS)- InChI=1/C30H52O3/c1-8-26(4)12-11-22-27(5,21(26)9-10-24(32)33)14-15-29(7)23-19-25(2,3)13-17-30(23,20-31)18-16-28(22,29)6/h21-23,31H,8-20H2,1-7H3,(H,32,33)/t21?,22?,23?,26-,27-,28+,29-,30+/m0/s1 UEEAECPGUNVURR-YAHDOYPUBY 3,4-Seco-28-hydroxyfriedelan-3-oic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(1-Vinyl-1H-pyrrol-2-yl)-pyridine 2-(1-vinyl-1H-pyrrol-2-yl)pyridine pyridine, 2-(1-ethenyl-1H-pyrrol-2-yl)- InChI=1/C11H10N2/c1-2-13-9-5-7-11(13)10-6-3-4-8-12-10/h2-9H,1H2 DRFXOBIWHKRWQY-UHFFFAOYAW 2-(2'-Pyridyl)pyrrole 2-(2-Pyridyl)-1-vinylpyrrole . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,1'-Divinyl-1H,1'H-[2,2']bipyrrolyl 1,1'-divinyl-1H,1'H-2,2'-bipyrrole 2,2'-bi-1H-pyrrole, 1,1'-diethenyl- InChI=1/C12H12N2/c1-3-13-9-5-7-11(13)12-8-6-10-14(12)4-2/h3-10H,1-2H2 AYXDDGITUUEGEK-UHFFFAOYAP 1,1'-Divinyl-2,2'-dipyrrole 1-Vinyl-2-(2'-1-vinylpyrrolyl)pyrrole . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,2,3,4,5,6,7,8-Octahydro-acridine 1,2,3,4,5,6,7,8-octahydroacridine acridine, 1,2,3,4,5,6,7,8-octahydro- InChI=1/C13H17N/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h9H,1-8H2 LLCXJIQXTXEQID-UHFFFAOYAR 1,2,3,4,5,6,7,8-Octahydro-acridine . Information we have got: NMR spectra 13C, 13C, 13C, 1H, 3D coordinates, File formats: CML, mol, png, jpeg
4-amino-N'-hydroxybenzenecarboximidamide benzenecarboximidamide, 4-amino-N'-hydroxy- InChI=1/C7H9N3O/c8-6-3-1-5(2-4-6)7(9)10-11/h1-4,11H,8H2,(H2,9,10) CNFNMMJKXWOLPY-UHFFFAOYAM 4-amino-benzamide oxime . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(2R,3S,4S,6S)-3-methoxy-2-methyl-4-(methylamino)-29-oxa-1,7,17-triazaoctacyclo[12.12.2.1~2,6~.0~7,28~.0~8,13~.0~15,19~.0~20,27~.0~21,26~]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one (non-prefe olean-12-en-29-oic acid, 3-hydroxy-, (3beta,5xi,9xi,18xi)- InChI=1/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17?,20-,26-,28+/m0/s1 HKSZLNNOFSGOKW-HMWZOHBLBX Staurosporine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a, 12b,13,14b-eicosahydro-picene-2-carboxylic acid (3beta,5xi,9xi,18xi)-3-hydroxyolean-12-en-29-oic acid olean-12-en-29-oic acid, 3-hydroxy-, (3beta,5xi,9xi,18xi)- InChI=1/C30H48O3/c1-25(2)21-10-13-30(7)22(28(21,5)12-11-23(25)31)9-8-19-20-18-27(4,24(32)33)15-14-26(20,3)16-17-29(19,30)6/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20?,21?,22?,23-,26+,27+,28-,29+,30+/m0/s1 JZFSMVXQUWRSIW-RZJUCFKDBN Epikatonic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-Oxo-tetrahydro-furan-2-carboxylic acid 5-oxotetrahydrofuran-2-carboxylic acid 2-furancarboxylic acid, tetrahydro-5-oxo- InChI=1/C5H6O4/c6-4-2-1-3(9-4)5(7)8/h3H,1-2H2,(H,7,8) QVADRSWDTZDDGR-UHFFFAOYAK 5-Oxotetrahydrofuran-2-carboxylic acid . Information we have got: NMR spectra 13C, 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6a,13a-dihydroxy-1,8-bis(4-hydroxyphenyl)-6a,13a,14d,14e-tetrahydronaphtho[8,1,2-hij]naphtho[2',1',8':1,8,7]isochromeno[5,4,3-cde]isochromene-7,14-dione naphtho[8,1,2-hij]naphtho[2',1',8':1,8,7][2]benzopyrano[5,4,3-cde][2]benzopyran-7,14-dione, 6a,13a,14d,14e-tetrahydro-6a,13a-dihydroxy-1,8-bis(4-hydroxyphenyl)- InChI=1/C38H22O8/c39-21-9-1-17(2-10-21)23-13-5-19-7-15-25-31-27(19)29(23)35(41)37(43)33(31)34-32-26(45-37)16-8-20-6-14-24(18-3-11-22(40)12-4-18)30(28(20)32)36(42)38(34,44)46-25/h1-16,33-34,39-40,43-44H MQHLUOTXEDJGPU-UHFFFAOYAA 4',4''-Dihydroxy-anigorootin 7b,14b-Dihydro-7a,14a-dihydroxy-6,13-di-(4-hydroxyphenyl)-(7H,14H)-diphenalen[2,3,3a,4-b,c,d:2,3,3a,4-g,h,i]pyrano[4,3-c]pyran-7,14-dione . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(6aR,13aR,14dR,14eR)-6a,13a-dihydroxy-1,8-diphenyl-6a,13a,14d,14e-tetrahydronaphtho[8,1,2-hij]naphtho[2',1',8':1,8,7]isochromeno[5,4,3-cde]isochromene-7,14-dione naphtho[8,1,2-hij]naphtho[2',1',8':1,8,7][2]benzopyrano[5,4,3-cde][2]benzopyran-7,14-dione, 6a,13a,14d,14e-tetrahydro-6a,13a-dihydroxy-1,8-diphenyl-, (6aR,13aR,14dR,14eR)- InChI=1/C38H22O6/c39-35-29-23(19-7-3-1-4-8-19)15-11-21-13-17-25-31(27(21)29)33-34-32-26(43-37(33,35)41)18-14-22-12-16-24(20-9-5-2-6-10-20)30(28(22)32)36(40)38(34,42)44-25/h1-18,33-34,41-42H/t33-,34-,37+,38+/m0/s1 YOXXPZVESHZYHK-QXOULVPSBQ Anigorootin rel-(7aR,7bR,14aR,14bR)-7b,14b-Dihydro-7a,14a-dihydroxy-6,13-diphenyl-(7H,14H)-diphenalen[2,3,3a,4-b,c,d:2,3,3a,4-g,h,i]pyrano[4,3-c]pyran-7,14-dione . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-Hydroxy-7-phenyl-benzo[de]isochromene-1,6-dione 5-hydroxy-7-phenyl-1H,6H-benzo[de]isochromene-1,6-dione 1H,6H-naphtho[1,8-cd]pyran-1,6-dione, 5-hydroxy-7-phenyl- InChI=1/C18H10O4/c19-14-8-11-9-22-18(21)13-7-6-12(10-4-2-1-3-5-10)16(15(11)13)17(14)20/h1-9,19H TUROAXCIAPETPG-UHFFFAOYAZ Lachnanthopyrone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
8-Hydroxy-3-oxo-6-phenyl-7-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-1H,3H-benzo[de]isochromene-1-carboxylic acid 7-(beta-glucopyranosyloxy)-8-hydroxy-3-oxo-6-phenyl-1H,3H-benzo[de]isochromene-1-carboxylic acid 1H,3H-naphtho[1,8-cd]pyran-1-carboxylic acid, 7-(beta-D-glucopyranosyloxy)-8-hydroxy-3-oxo-6-phenyl- InChI=1/C25H22O11/c26-9-15-18(28)19(29)20(30)25(34-15)36-22-14(27)8-13-16-12(24(33)35-21(13)23(31)32)7-6-11(17(16)22)10-4-2-1-3-5-10/h1-8,15,18-21,25-30H,9H2,(H,31,32)/t15-,18-,19+,20-,21?,25+/m1/s1 KUYMUCQWUSNZOX-SUKHPEAHBK 3-Carboxy-5-hydroxy-6-O-β-D-glucopyranosyl-7-phenyl-3H-benzo[de]isochromen-1-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Hydroxy-9-phenyl-phenalen-1-one 2-hydroxy-9-phenyl-1H-phenalen-1-one 1H-phenalen-1-one, 2-hydroxy-9-phenyl- InChI=1/C19H12O2/c20-16-11-14-8-4-7-13-9-10-15(12-5-2-1-3-6-12)18(17(13)14)19(16)21/h1-11,20H ACJJXELQAJQSLK-UHFFFAOYAT Anigorufone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-{4-Hydroxy-2-(4-hydroxy-phenyl)-6-[2-(4-hydroxy-phenyl)-vinyl]-benzofuran-3-yl}-benzene-1,3-diol 5-{4-hydroxy-2-(4-hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)vinyl]-1-benzofuran-3-yl}benzene-1,3-diol 1,3-benzenediol, 5-[4-hydroxy-2-(4-hydroxyphenyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-3-benzofuranyl]- InChI=1/C28H20O6/c29-20-7-3-16(4-8-20)1-2-17-11-24(33)27-25(12-17)34-28(18-5-9-21(30)10-6-18)26(27)19-13-22(31)15-23(32)14-19/h1-15,29-33H/b2-1+ PKURHFYJMWBEEX-OWOJBTEDBN Anigopreissin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-Hydroxy-7'-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-[6,8']bichromenyl-2,2'-dione 7-hydroxy-2,2'-dioxo-2H,2'H-6,8'-bichromen-7'-yl 6-deoxyhexopyranoside [6,8'-bi-2H-1-benzopyran]-2,2'-dione, 7'-[(6-deoxyhexopyranosyl)oxy]-7-hydroxy- InChI=1/C24H20O10/c1-10-20(28)21(29)22(30)24(31-10)33-15-5-2-11-3-6-18(27)34-23(11)19(15)13-8-12-4-7-17(26)32-16(12)9-14(13)25/h2-10,20-22,24-25,28-30H,1H3 KUTYZRVAZIEYCQ-UHFFFAOYAQ 7-O-α-L-rhamnosyl-8-[2-oxo-2H-1-benzopyran-7'-(hydroxy)-6'-yl]-2H-1-benzopyran-2-one Daphjamilin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(6,6-Dimethyl-bicyclo[3.1.1]hept-2-en-2-yl)-methanol (6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)methanol bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl- InChI=1/C10H16O/c1-10(2)8-4-3-7(6-11)9(10)5-8/h3,8-9,11H,4-6H2,1-2H3 RXBQNMWIQKOSCS-UHFFFAOYAN Myrtenol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,2-Dimethyl-7,7-dioxo-3-oxa-7lambda*6*-thia-2,8-diaza-tricyclo[6.2.1.0*4,10*]undecane-6-carboxylic acid isopropyl ester isopropyl 2,3-dimethylhexahydro-4H-3,5-methanoisoxazolo[4,5-d][1,2]thiazepine-7-carboxylate 6,6-dioxide 4H-3,5-methanoisoxazolo[4,5-d][1,2]thiazepine-7-carboxylic acid, hexahydro-2,3-dimethyl-, 1-methylethyl ester, 6,6-dioxide InChI=1/C13H22N2O5S/c1-8(2)19-12(16)11-5-10-9-6-15(21(11,17)18)7-13(9,3)14(4)20-10/h8-11H,5-7H2,1-4H3 DCWKRGFEBFUJOU-UHFFFAOYAT 1,2-Dimethyl-7,7-dioxo-3-oxa-7lambda*6*-thia-2,8-diaza-tricyclo[6.2.1.0*4,10*]undecane-6-carboxylic acid isopropyl ester . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,1-Dioxo-2-(2-oxo-propyl)-2,3,6,7-tetrahydro-1H-1lambda*6*-[1,2]thiazepine-7-carboxylic acid isopropyl ester isopropyl 2-(2-oxopropyl)-2,3,6,7-tetrahydro-1,2-thiazepine-7-carboxylate 1,1-dioxide 1,2-thiazepine-7-carboxylic acid, 2,3,6,7-tetrahydro-2-(2-oxopropyl)-, 1-methylethyl ester, 1,1-dioxide InChI=1/C12H19NO5S/c1-9(2)18-12(15)11-6-4-5-7-13(8-10(3)14)19(11,16)17/h4-5,9,11H,6-8H2,1-3H3 JTLTYOOXOIJKRC-UHFFFAOYAW 1,1-Dioxo-2-(2-oxo-propyl)-2,3,6,7-tetrahydro-1H-1lambda*6*-[1,2]thiazepine-7-carboxylic acid isopropyl ester . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
ethyl [phenyl(phenylammonio)methyl]phosphonate phosphonic acid, [phenyl(phenylamino)methyl]-, monoethyl ester InChI=1/C15H18NO3P/c1-2-19-20(17,18)15(13-9-5-3-6-10-13)16-14-11-7-4-8-12-14/h3-12,15-16H,2H2,1H3,(H,17,18) FXIAAFILGDDMRW-UHFFFAOYAC monoethyl ester of (α-anilinobenzyl)phosphonic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
9-Pyridin-4-yl-1,2,3,4,5,6,7,8-octahydro-acridine 10-oxide 9-pyridin-4-yl-1,2,3,4,5,6,7,8-octahydroacridine 10-oxide acridine, 1,2,3,4,5,6,7,8-octahydro-9-(4-pyridinyl)-, 10-oxide InChI=1/C18H20N2O/c21-20-16-7-3-1-5-14(16)18(13-9-11-19-12-10-13)15-6-2-4-8-17(15)20/h9-12H,1-8H2 AMHSKSYDKNPLIE-UHFFFAOYAM 1,2,3,4,5,6,7,8-Octahydro-9-(4-pyridyl)acridine-10-oxide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,10-Dimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,9-diol 1,10-dimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,9-diol 4H-dibenzo[de,g]quinoline-2,9-diol, 5,6,6a,7-tetrahydro-1,10-dimethoxy- InChI=1/C18H19NO4/c1-22-15-8-11-10(7-13(15)20)5-12-16-9(3-4-19-12)6-14(21)18(23-2)17(11)16/h6-8,12,19-21H,3-5H2,1-2H3 KYVJVURXKAZJRK-UHFFFAOYAR 1,10-Dimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,9-diol Norboldine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1R,9'R)-9'-{[(2-{6-[(Z)-(4,5-dimethoxy-3-oxo-2-benzofuran-1(3H)-ylidene)methyl]-1,3-benzodioxol-5-yl}ethyl)(methyl)amino]oxy}-4,5-dimethoxy-1'-methyl-1',3a',9',9a'-tetrahydro-3H-spiro[2-benzofura spiro[3H--1,3dioxolo[5,6]indeno[2,1-c]isoxazole-3,1'(3'H)-isobenzofuran]-3'-one, 9-[[[2-[6-[(Z)-(4,5-dimethoxy-3-oxo-1(3H)-isobenzofuranylidene)methyl]-1,3-benzodioxol-5-yl]ethyl]methylamino]oxy]-1,3a InChI=1/C42H38N2O14/c1-43(12-11-20-13-29-30(52-18-51-29)15-21(20)14-28-22-7-9-26(47-3)38(49-5)33(22)40(45)55-28)57-37-24-17-32-31(53-19-54-32)16-23(24)35-36(37)44(2)58-42(35)25-8-10-27(48-4)39(50-6)34(25)41(46)56-42/h7-10,13-17,35-37H,11-12,18-19H2,1-6H3 ONEBGTTTZOMIQM-SGQGIDGUBD Dactylicapnosine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-(8a-carboxy-4-formyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-eicosahydro-picen-3-yloxy)-3,4,5-trihydroxy-tetrahydro-pyran-2-carboxylic acid (3beta,5xi,9xi,18xi)-28-hydroxy-23,28-dioxoolean-12-en-3-yl hexopyranosiduronic acid olean-12-en-28-oic acid, 3-(hexopyranuronosyloxy)-23-oxo-, (3beta,5xi,9xi,18xi)- InChI=1/C36H54O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29-26(40)24(38)25(39)27(46-29)28(41)42/h7,18,20-27,29,38-40H,8-17H2,1-6H3,(H,41,42)(H,43,44)/t20?,21?,22?,23-,24?,25?,26?,27?,2 NUSHOJSYOLRGAX-ZFLCUDBIBJ Gypsogenin 3-O-glucuronide Vaccarosid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Hydroxy-pentanedioic acid 2-hydroxypentanedioic acid pentanedioic acid, 2-hydroxy- InChI=1/C5H8O5/c6-3(5(9)10)1-2-4(7)8/h3,6H,1-2H2,(H,7,8)(H,9,10) HWXBTNAVRSUOJR-UHFFFAOYAI 2-Hydroxyglutaric acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,3-Dihydro-1H,3'H-[1,5']biindenyl 2,3-dihydro-1H,3'H-1,5'-biindene 1,6'-bi-1H-indene, 2,3-dihydro- InChI=1/C18H16/c1-2-7-17-14(4-1)10-11-18(17)16-9-8-13-5-3-6-15(13)12-16/h1-5,7-9,12,18H,6,10-11H2 RZZOGOCKMMVZLW-UHFFFAOYAL 6-(2’,3’-dihydro-1’H-inden-1’-yl)-1H-indene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
17-(2,3-dihydroxy-1,4,5-trimethyl-hexyl)-2,3-dihydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-6-one rel-(2alpha,3alpha,8xi,9xi,14xi,22R,23R)-2,3,22,23-tetrahydroxyergostan-6-one ergostan-6-one, 2,3,22,23-tetrahydroxy-, (2alpha,3alpha,8xi,9xi,14xi,22R,23R)- InChI=1/C28H48O5/c1-14(2)15(3)25(32)26(33)16(4)18-7-8-19-17-11-22(29)21-12-23(30)24(31)13-28(21,6)20(17)9-10-27(18,19)5/h14-21,23-26,30-33H,7-13H2,1-6H3/t15-,16+,17?,18-,19?,20?,21?,23+,24-,25-,26-,27-,28-/m1/s1 UDGAZJBIQSMLJW-PEEWTVLGBM 2αa,3αa-22R,23R-tetrahydroxy-24R-methyl-5α-cholestan-6-one 24-epi-Castasterone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(2alpha,3beta,8xi,9xi,19S)-2,14-dihydroxy-19-methoxy-3,19-epoxycard-20(22)-enolide card-20(22)-enolide, 3,19-epoxy-2,14-dihydroxy-19-methoxy-, (2alpha,3beta,8xi,9xi)- InChI=1/C24H34O6/c1-22-7-5-16-17(24(22,27)8-6-15(22)13-9-20(26)29-12-13)4-3-14-10-19-18(25)11-23(14,16)21(28-2)30-19/h9,14-19,21,25,27H,3-8,10-12H2,1-2H3/t14?,15-,16?,17?,18-,19-,21+,22-,23-,24+/m1/s1 NMGALPFPYHFHIG-POVWCMRGBD (19S)-3β,19-Epoxy-2α,3β,14β-trihydroxy-19-methoxy-5α-card-20(22)-enolide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(2,6-Dichloro-phenyl)-1,1-dioxo-2,3,4,5,6,7-hexahydro-1H-1lambda*6*-benzo[d]isothiazol-3-yl-hydroperoxide 2-(2,6-dichlorophenyl)-1,1-dioxido-2,3,4,5,6,7-hexahydro-1,2-benzisothiazol-3-yl hydroperoxide hydroperoxide, 2-(2,6-dichlorophenyl)-2,3,4,5,6,7-hexahydro-1,1-dioxido-1,2-benzisothiazol-3-yl InChI=1/C13H13Cl2NO4S/c14-9-5-3-6-10(15)12(9)16-13(20-17)8-4-1-2-7-11(8)21(16,18)19/h3,5-6,13,17H,1-2,4,7H2 QKJPQNRUHPBFPV-UHFFFAOYAZ 2-(2,6-Dichlorophenyl)-2,3,4,5,6,7-hexahydro-3-hydroperoxy-1,2-benzisothiazole 1,1-Dioxide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,1-Dioxo-2-phenyl-2,3,4,5,6,7-hexahydro-1H-1lambda*6*-benzo[d]isothiazol-3-ol 2-phenyl-2,3,4,5,6,7-hexahydro-1,2-benzisothiazol-3-ol 1,1-dioxide 1,2-benzisothiazol-3-ol, 2,3,4,5,6,7-hexahydro-2-phenyl-, 1,1-dioxide InChI=1/C13H15NO3S/c15-13-11-8-4-5-9-12(11)18(16,17)14(13)10-6-2-1-3-7-10/h1-3,6-7,13,15H,4-5,8-9H2 MQBSKTZHMFNZDP-UHFFFAOYAQ 2,3,4,5,6,7-Hexahydro-3-hydroxy-2-phenyl-1,2-benzisothiazole 1,1-Dioxide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(2,6-Dichloro-phenyl)-1,1-dioxo-1,2,4,5,6,7-hexahydro-1lambda*6*-benzo[d]isothiazol-3-one 2-(2,6-dichlorophenyl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide 1,2-benzisothiazol-3(2H)-one, 2-(2,6-dichlorophenyl)-4,5,6,7-tetrahydro-, 1,1-dioxide InChI=1/C13H11Cl2NO3S/c14-9-5-3-6-10(15)12(9)16-13(17)8-4-1-2-7-11(8)20(16,18)19/h3,5-6H,1-2,4,7H2 LJNVVDNZMYSCFM-UHFFFAOYAE 2-(2,6-Dichlorophenyl)-4,5,6,7-tetrahydro-1,2-benzisothiazol-3(2H)-one 1,1-Dioxide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Methyl-acrylic acid 6,9-dimethyl-3-methylene-2,7-dioxo-2,3,3a,4,5,7,9a,9b-octahydro-azuleno[4,5-b]furan-4-yl ester (3aR,4R,9aS,9bR)-6,9-dimethyl-3-methylene-2,7-dioxo-2,3,3a,4,5,7,9a,9b-octahydroazuleno[4,5-b]furan-4-yl rel-2-methylacrylate 2-propenoic acid, 2-methyl-, (3aR,4R,9aS,9bR)-2,3,3a,4,5,7,9a,9b-octahydro-6,9-dimethyl-3-methylene-2,7-dioxoazuleno[4,5-b]furan-4-yl ester InChI=1/C19H20O5/c1-8(2)18(21)23-13-7-10(4)14-12(20)6-9(3)15(14)17-16(13)11(5)19(22)24-17/h6,13,15-17H,1,5,7H2,2-4H3/t13-,15+,16-,17-/m1/s1 KFNIILPAQWDAJK-XLNGHYISBG 2-One-8β-methacryloyloxy-guaia-1(10),3,11(13)-trien-6α,12-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Methyl-acrylic acid 8,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydro-cyclodeca[b]furan-4-yl ester (3aR,4R,6E,8R,9R,10E,11aR)-8,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl rel-2-methylacrylate 2-propenoic acid, 2-methyl-, (3aR,4R,6E,8R,9R,10E,11aR)-2,3,3a,4,5,8,9,11a-octahydro-8,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester InChI=1/C19H24O6/c1-9(2)18(22)24-14-7-10(3)6-13(20)17(21)11(4)8-15-16(14)12(5)19(23)25-15/h6,8,13-17,20-21H,1,5,7H2,2-4H3/b10-6+,11-8+/t13-,14-,15-,16-,17-/m1/s1 GMPAIJGBZPIKAZ-LOYCJOEVBV 2α,3β-Dihydroxy-8β-methacryloyloxy-germacra-1(10),4,11(13)-trien-6α,12-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Phenyl-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-acetonitrile (alpha-allopyranosyloxy)(phenyl)acetonitrile benzeneacetonitrile, alpha-(beta-D-allopyranosyloxy)- InChI=1/C14H17NO6/c15-6-9(8-4-2-1-3-5-8)20-14-13(19)12(18)11(17)10(7-16)21-14/h1-5,9-14,16-19H,7H2/t9?,10-,11-,12-,13-,14-/m1/s1 ZKSZEJFBGODIJW-YHBOFVJABI (2R)-β-D-Allopyranosyloxy-2-phenylacetonitrile . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 6,6,9a-trimethyl-2-methylene-decahydro-1,5-cyclo-benzocyclohepten-3-yl ester (1R,2R,7R,8S,10S)-2,6,6-trimethyl-9-methylenetricyclo[5.4.0.0~2,8~]undec-10-yl rel-acetate tricyclo[5.4.0.0~2,8~]undecan-10-ol, 2,6,6-trimethyl-9-methylene-, acetate, (1S,2S,7S,8R,10R)- InChI=1/C17H26O2/c1-10-13(19-11(2)18)9-12-15-14(10)17(12,5)8-6-7-16(15,3)4/h12-15H,1,6-9H2,2-5H3/t12-,13+,14+,15-,17-/m0/s1 RCEFXIVQCAIFDV-CEEVZKBLBN (-)-4-epi-Marsupellol acetate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 3a,4,8a-trimethyl-7-methylene-decahydro-4,8-methano-azulen-6-yl ester (3aR,4S,6R,8S,8aS)-3a,4,8a-trimethyl-7-methylenedecahydro-4,8-methanoazulen-6-yl rel-acetate 4,8-methanoazulen-6-ol, decahydro-3a,4,8a-trimethyl-7-methylene-, acetate, (3aR,4S,6R,8S,8aS)- InChI=1/C17H26O2/c1-11-13-9-15(3,10-14(11)19-12(2)18)17(5)8-6-7-16(13,17)4/h13-14H,1,6-10H2,2-5H3/t13-,14-,15+,16+,17-/m1/s1 PLOQFTYPCAOTDW-UHDSXZAQBJ (-)-9-Acetoxygymnomitr-8(12)-ene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-Hydroxy-2',2'-dimethyl-6-(3-methyl-but-2-enyl)-2,3-dihydro-2'H-[2,6']bichromenyl-4-one 7-hydroxy-2',2'-dimethyl-6-(3-methylbut-2-en-1-yl)-2,3-dihydro-2'H,4H-2,6'-bichromen-4-one [2,6'-bi-2H-1-benzopyran]-4(3H)-one, 7-hydroxy-2',2'-dimethyl-6-(3-methyl-2-butenyl)- InChI=1/C25H26O4/c1-15(2)5-6-16-12-19-21(27)14-23(28-24(19)13-20(16)26)17-7-8-22-18(11-17)9-10-25(3,4)29-22/h5,7-13,23,26H,6,14H2,1-4H3 XPMXYEFQBQWMEC-UHFFFAOYAC (-)-6-(3,3-Dimethylallyl)-7-hydroxy-6''',6'''-dimethylchromeno-(4',3',2''',3''')-flavanone Dinklagin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
12-Benzyl-6-hydroxymethyl-3-(1H-indol-3-ylmethyl)-9,15-diisopropyl-18-methyl-1,4,7,10,13,16,19heptaaza-cyclotricosane-2,5,8,11,14,17,20-heptaone rel-(3R,6S,9R,12S,15R,18R)-12-benzyl-6-(hydroxymethyl)-3-(1H-indol-3-ylmethyl)-9,15-diisopropyl-18-methyl-1,4,7,10,13,16,19-heptaazacyclotricosane-2,5,8,11,14,17,20-heptone 3-dibenzofuranol, 8-chloro-7-methoxy-1,9-dimethyl- InChI=1/C40H54N8O8/c1-22(2)33-39(55)45-29(18-25-12-7-6-8-13-25)37(53)48-34(23(3)4)40(56)46-31(21-49)38(54)44-30(19-26-20-42-28-15-10-9-14-27(26)28)36(52)41-17-11-16-32(50)43-24(5)35(51)47-33/h6-10,12-15,20,22-24,29-31,33-34,42,49H,11,16-19,21H2,1-5H3,(H, DYUXTXRHHWGWDU-RNCACNLSBM Unguisin C . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
8-Chloro-7-methoxy-1,9-dimethyl-dibenzofuran-3-ol 8-chloro-7-methoxy-1,9-dimethyldibenzo[b,d]furan-3-ol 3-dibenzofuranol, 8-chloro-7-methoxy-1,9-dimethyl- InChI=1/C15H13ClO3/c1-7-4-9(17)5-10-13(7)14-8(2)15(16)12(18-3)6-11(14)19-10/h4-6,17H,1-3H3 QACFBZKFGZSWFE-UHFFFAOYAF 2-Chloro-7-hydroxy-3-methoxy-1,9-dimethyldibenzofuran . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(3aR,4R,5R,5aS,6aR,7S,9S,9aS)-4,5,7,9-tetrahydroxy-4,7-dimethyl-1-methyleneoctahydro-3aH-oxireno[1,8a]azuleno[4,5-b]furan-2(1H)-one 4H-oxireno[1,8a]azuleno[4,5-b]furan-2(1H)-one, octahydro-4,5,7,9-tetrahydroxy-4,7-dimethyl-1-methylene-, (3aS,4S,5S,5aR,6aS,7R,9R,9aR)- InChI=1/C15H20O7/c1-5-7-6(16)4-13(2,19)15-9(8(7)21-12(5)18)14(3,20)10(17)11(15)22-15/h6-11,16-17,19-20H,1,4H2,2-3H3/t6-,7-,8+,9?,10+,11-,13-,14+,15+/m1/s1 VBYYZOIDIMKVGL-IMXZXUQOBH 1β,2β-Epoxy-3β,4α,8β,10α-tetrahydroxyguaia-11(13)-en-12,6α-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-Hydroxy-3-methoxy-benzoic acid 3,8-dihydroxy-3-isopropyl-6,8a-dimethyl-1-oxo-1,2,3,3a,4,5,8,8a-octahydro-azulen-4-yl ester (3R,3aS,4R,8R,8aS)-3,8-dihydroxy-3-isopropyl-6,8a-dimethyl-1-oxo-1,2,3,3a,4,5,8,8a-octahydroazulen-4-yl rel-4-hydroxy-3-methoxybenzoate benzoic acid, 4-hydroxy-3-methoxy-, (3R,3aS,4R,8R,8aS)-1,2,3,3a,4,5,8,8a-octahydro-3,8-dihydroxy-6,8a-dimethyl-3-(1-methylethyl)-1-oxo-4-azulenyl ester InChI=1/C23H30O7/c1-12(2)23(28)11-19(26)22(4)18(25)9-13(3)8-17(20(22)23)30-21(27)14-6-7-15(24)16(10-14)29-5/h6-7,9-10,12,17-18,20,24-25,28H,8,11H2,1-5H3/t17-,18-,20-,22+,23-/m1/s1 OBKNOQAROVHENZ-YPBQMLHOBD Kuhistanicaol I . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-Hydroxy-benzoic acid 3,6-dihydroxy-3-isopropyl-6,8a-dimethyl-7-oxo-decahydro-azulen-4-yl ester (3R,3aS,4S,6S,8aR)-3,6-dihydroxy-3-isopropyl-6,8a-dimethyl-7-oxodecahydroazulen-4-yl rel-4-hydroxybenzoate benzoic acid, 4-hydroxy-, (3R,3aS,4S,6S,8aR)-decahydro-3,6-dihydroxy-6,8a-dimethyl-3-(1-methylethyl)-7-oxo-4-azulenyl ester InChI=1/C22H30O6/c1-13(2)22(27)10-9-20(3)12-17(24)21(4,26)11-16(18(20)22)28-19(25)14-5-7-15(23)8-6-14/h5-8,13,16,18,23,26-27H,9-12H2,1-4H3/t16-,18+,20+,21-,22+/m0/s1 SDXQLRZOKZYCOX-FVQLTZBIBX Kuhistanicaol J . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-Hydroxy-2-(3-hydroxy-2,4-dimethoxy-phenyl)-6-methoxy-benzofuran-3-carbaldehyde 4-hydroxy-2-(3-hydroxy-2,4-dimethoxyphenyl)-6-methoxy-1-benzofuran-3-carbaldehyde 3-benzofurancarboxaldehyde, 4-hydroxy-2-(3-hydroxy-2,4-dimethoxyphenyl)-6-methoxy- InChI=1/C18H16O7/c1-22-9-6-12(20)15-11(8-19)17(25-14(15)7-9)10-4-5-13(23-2)16(21)18(10)24-3/h4-8,20-21H,1-3H3 XDUYDNPZEINTJY-UHFFFAOYAY 2-(2',4'-Dimethoxy-3'-hydroxyphenyl)-4-hydroxy-6-methoxy-benzofuran-3-carbaldehyde Andinermal A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
8-Isopropylidene-5,6-dimethyl-9-oxa-tricyclo[5.2.2.0^(1,6)]undecane rel-(3aR,7S,7aS)-7,7a-dimethyl-9-(1-methylethylidene)octahydro-3a,1-(epoxymethano)indene 2H-3,7a-ethanobenzofuran, hexahydro-3a,4-dimethyl-2-(1-methylethylidene)-, (3aS,4S,7aR)- InChI=1/C15H24O/c1-10(2)13-12-7-9-15(16-13)8-5-6-11(3)14(12,15)4/h11-12H,5-9H2,1-4H3/t11-,12?,14-,15+/m0/s1 PZCSYTCRKFMIOB-MYZSUADSBI (+)-(1R,5S,6S,7S)-5,6-Dimethyl-9-oxo-8-isopropylidene-tricyclo[5.2.2.0^(1,6)]undecane (+)-7,10-Anhydro-11,12-dihydrochiloscypholone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-Mercapto-2-oxo-1,2-dihydro-quinoline-4-carbaldehyde 1-mercapto-2-oxo-1,2-dihydroquinoline-4-carbaldehyde 4-quinolinecarboxaldehyde, 1,2-dihydro-1-mercapto-2-oxo- InChI=1/C10H7NO2S/c12-6-7-5-10(13)11(14)9-4-2-1-3-8(7)9/h1-6,14H ZEPFEQYCJVHPET-UHFFFAOYAB N-Mercapto-4-formylcarbostyril . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Benzoic acid 2-oxo-3-(5-oxo-5H-furan-2-ylidene)-propyl ester (3Z)-2-oxo-3-(5-oxofuran-2(5H)-ylidene)propyl benzoate 2(5H)-furanone, 5-[3-(benzoyloxy)-2-oxopropylidene]-, (5Z)- InChI=1/C14H10O5/c15-11(8-12-6-7-13(16)19-12)9-18-14(17)10-4-2-1-3-5-10/h1-8H,9H2/b12-8- RMGZBKKDFZICCQ-WQLSENKSBA 7-Benzoyloxy-6-oxo-2,4Z-heptadiene-1,4-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(4aR,6aS,8S,9S,11aR,11bS)-4,4,9,11b-tetramethyltetradecahydro-8,11a-methanocyclohepta[a]naphthalene-2,3,9-triol 8,11a-methano-11aH-cyclohepta[a]naphthalene-2,3,9-triol, tetradecahydro-4,4,9,11b-tetramethyl-, (4aR,6aS,8S,9S,11aR,11bS)- InChI=1/C20H34O3/c1-17(2)15-6-5-12-9-13-10-20(12,8-7-19(13,4)23)18(15,3)11-14(21)16(17)22/h12-16,21-23H,5-11H2,1-4H3/t12-,13-,14?,15-,16?,18-,19-,20+/m0/s1 RQDMNTGFNDFLHP-GCEPCATDBU 2α,3β,13-Trihydroxystemodane . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-(1,1-Dimethyl-allyl)-3-(4-hydroxy-2-methoxy-phenyl)-2H-chromen-7-ol 6-(1,1-dimethylprop-2-en-1-yl)-3-(4-hydroxy-2-methoxyphenyl)-2H-chromen-7-ol 2H-1-benzopyran-7-ol, 6-(1,1-dimethyl-2-propenyl)-3-(4-hydroxy-2-methoxyphenyl)- InChI=1/C21H22O4/c1-5-21(2,3)17-9-13-8-14(12-25-19(13)11-18(17)23)16-7-6-15(22)10-20(16)24-4/h5-11,22-23H,1,12H2,2-4H3 VJEUNRYOMSNQQE-UHFFFAOYAO 7,4'-Dihydroxy-2'-methoxy-6-(1'',1''-dimethylallyl)isoflav-3-ene Burttinol A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(3R)-3-[(3R,4aR,7aR,8aS,9R,11R,11aR,11bS,11cS,13bR)-3,11-dihydroxy-11c,13b-dimethyl-2,3,4,4a,5,6,7a,8a,9,11,11a,11b,11c,12,13,13b-hexadecahydro-1H-furo[3,4-b]naphtho[2',1':4,5]indeno[1,2-d]furan-9 9(1H)-phenanthrenone, 2,3,4,4a,10,10a-hexahydro-2,5,8-trihydroxy-6-methoxy-1,1,4a-trimethyl-7-(1-methylethyl)-, (2S,4aS)- InChI=1/C29H42O6/c1-14(2)29(33,15(3)30)25-24-22(26(32)35-25)23-21(34-24)13-20-18-7-6-16-12-17(31)8-10-27(16,4)19(18)9-11-28(20,23)5/h13-14,16-17,21-26,31-33H,6-12H2,1-5H3/t16-,17-,21-,22-,23+,24+,25-,26-,27-,28-,29+/m0/s1 JRQNTPWYRBOEKO-MYBJFWHHBA 16β,22R;21,23S-Diepoxy-3β,21S,24-trihydroxystigmasta-8,14-dien-28-one Vernoguinosterol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,5,8-Trihydroxy-7-isopropyl-6-methoxy-1,1,4a-trimethyl-2,3,4,4a,10,10a-hexahydro-1H-phenanthren-9-one (3beta,5xi)-3,11,14-trihydroxy-12-methoxyabieta-8,11,13-trien-7-one 9(1H)-phenanthrenone, 2,3,4,4a,10,10a-hexahydro-2,5,8-trihydroxy-6-methoxy-1,1,4a-trimethyl-7-(1-methylethyl)-, (2S,4aS)- InChI=1/C21H30O5/c1-10(2)14-17(24)15-11(22)9-12-20(3,4)13(23)7-8-21(12,5)16(15)18(25)19(14)26-6/h10,12-13,23-25H,7-9H2,1-6H3/t12?,13-,21-/m0/s1 PRKBLPCDOOARTE-IFUBYHAABD (3S,5R,10S)-7-oxo-12-methoxyabieta-8,11,13-triene-3,11,14-triol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(3,7-Dimethyl-octa-2,6-dienyl)-3,5-dihydroxy-6-(3-methyl-but-2-enyl)-[1,4]benzoquinone 2-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-3,5-dihydroxy-6-(3-methylbut-2-en-1-yl)benzo-1,4-quinone 2,5-cyclohexadiene-1,4-dione, 2-[(2E)-3,7-dimethyl-2,6-octadienyl]-3,5-dihydroxy-6-(3-methyl-2-butenyl)- InChI=1/C21H28O4/c1-13(2)7-6-8-15(5)10-12-17-18(22)16(11-9-14(3)4)19(23)21(25)20(17)24/h7,9-10,23-24H,6,8,11-12H2,1-5H3/b15-10+ PZCXZESJSLZOSM-XNTDXEJSBN 2,6-Dihydroxyl-3-geranyl-5-isoprenyl-2,5-dihexadiene-1,4-dione Erectquione A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Isobutyric acid 12-(1-hydroxy-1-methyl-ethyl)-9-methyl-4-(3-methyl-but-2-enyl)-3,6-dioxo-8-oxa-tricyclo[7.3.1.0^(2,7)]trideca-2(7),4-dien-5-yl ester (2R,5S,6S)-5-(1-hydroxy-1-methylethyl)-2-methyl-8-(3-methylbut-2-en-1-yl)-7,10-dioxo-3,4,5,6,7,10-hexahydro-2H-2,6-methano-1-benzoxocin-9-yl rel-2-methylpropanoate propanoic acid, 2-methyl-, (2R,5S,6S)-3,4,5,6,7,10-hexahydro-5-(1-hydroxy-1-methylethyl)-2-methyl-8-(3-methyl-2-butenyl)-7,10-dioxo-2,6-methano-2H-1-benzoxocin-9-yl ester InChI=1/C25H34O6/c1-13(2)8-9-15-19(26)18-16-12-25(7,11-10-17(16)24(5,6)29)31-22(18)20(27)21(15)30-23(28)14(3)4/h8,14,16-17,29H,9-12H2,1-7H3/t16?,17-,25+/m0/s1 JTTNQUCEWDQPMF-XOWTYJCDBL Erectquione C . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(4-Hydroxy-3-methoxy-phenyl)-acrylic acid 2-cyano-4-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-but-2-enyl ester (2E)-2-cyano-4-(hexopyranosyloxy)but-2-en-1-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)acrylate 2-propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, (2E)-2-cyano-4-(hexopyranosyloxy)-2-butenyl ester, (2E)- InChI=1/C21H25NO10/c1-29-15-8-12(2-4-14(15)24)3-5-17(25)31-11-13(9-22)6-7-30-21-20(28)19(27)18(26)16(10-23)32-21/h2-6,8,16,18-21,23-24,26-28H,7,10-11H2,1H3/b5-3+,13-6+ ZZGPJESHTGYKSG-ZQDGOMPYBD 2-trans-feruloyloxymethyl-4-β-D-glucopyranosyloxy-2(E)-butenenitrile Nigrumin-5-ferulate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,7-Dihydroxy-2,4-dimethyl-benzofuran-3-one 2,7-dihydroxy-2,4-dimethyl-1-benzofuran-3(2H)-one 3(2H)-benzofuranone, 2,7-dihydroxy-2,4-dimethyl- InChI=1/C10H10O4/c1-5-3-4-6(11)8-7(5)9(12)10(2,13)14-8/h3-4,11,13H,1-2H3 DCRGULRFFRBGTR-UHFFFAOYAF 2,7-Dihydroxy-2,4-dimethyl-3(2H)-benzofuranone Enalin A . Information we have got: NMR spectra 13C, 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-(1-Ethoxy-ethyl)-7-methoxy-1,8-dimethyl-9,10-dihydro-phenanthren-2-ol 5-(1-ethoxyethyl)-7-methoxy-1,8-dimethyl-9,10-dihydrophenanthren-2-ol 2-phenanthrenol, 5-(1-ethoxyethyl)-9,10-dihydro-7-methoxy-1,8-dimethyl- InChI=1/C21H26O3/c1-6-24-14(4)18-11-20(23-5)13(3)16-8-7-15-12(2)19(22)10-9-17(15)21(16)18/h9-11,14,22H,6-8H2,1-5H3 HKDMRMBNAJOLLE-UHFFFAOYAZ 5-(1-Ethoxy-ethyl)-2-hydroxy-7-methoxy-1,8-dimethyl-9,10-dihydrophenanthrene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
10-Hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydro-2H-picene-4a-carboxylic acid methyl ester methyl (3beta)-3-hydroxyurs-12-en-28-oate urs-12-en-28-oic acid, 3-hydroxy-, methyl ester, (3beta)- InChI=1/C31H50O3/c1-19-11-16-31(26(33)34-8)18-17-29(6)21(25(31)20(19)2)9-10-23-28(5)14-13-24(32)27(3,4)22(28)12-15-30(23,29)7/h9,19-20,22-25,32H,10-18H2,1-8H3/t19-,20+,22+,23-,24+,25+,28+,29-,30-,31+/m1/s1 YCBSMEKEDOHEQI-QHQGJMPNBL 3β-Hydroxy-urs-12-en-28-oic acid methyl ester Methyl 3β-hydroxyurs-12-en-28-oate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(3,7-Dimethyl-octa-2,6-dienyl)-4-hydroxy-6-(2-hydroxy-propyl)-pyran-2-one 3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-4-hydroxy-6-(2-hydroxypropyl)-2H-pyran-2-one 2H-pyran-2-one, 3-[(2E)-3,7-dimethyl-2,6-octadienyl]-4-hydroxy-6-(2-hydroxypropyl)- InChI=1/C18H26O4/c1-12(2)6-5-7-13(3)8-9-16-17(20)11-15(10-14(4)19)22-18(16)21/h6,8,11,14,19-20H,5,7,9-10H2,1-4H3/b13-8+ PCBUUYMKRTWQSY-MDWZMJQEBL 3-Geranyl-4-hydroxy-6-(2-hydroxypropyl)-2-pyrone Aurantiacone . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,2,3,7-Tetramethoxy-6-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-xanthen-9-one 2,6,7,8-tetramethoxy-9-oxo-9H-xanthen-3-yl hexopyranoside 9H-xanthen-9-one, 6-(hexopyranosyloxy)-1,2,3,7-tetramethoxy- InChI=1/C23H26O12/c1-29-11-5-9-10(6-12(11)34-23-20(28)19(27)18(26)15(8-24)35-23)33-13-7-14(30-2)21(31-3)22(32-4)16(13)17(9)25/h5-7,15,18-20,23-24,26-28H,8H2,1-4H3 SBPPUWCOLBWYPO-UHFFFAOYAL 6-O-(β-D-glucopyranosyl)-1,2,3,7,-tetramethoxyxanthone Polygalaxanthone VI . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6,7-Dihydroxy-3-(2-hydroxy-phenyl)-5-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxymethyl)-hexahydro-pyrano[2,3-d]oxazol-2-one [6,7-dihydroxy-3-(2-hydroxyphenyl)-2-oxohexahydro-2H-pyrano[2,3-d][1,3]oxazol-5-yl]methyl hexopyranoside 2H-pyrano[2,3-d]oxazol-2-one, 5-[(hexopyranosyloxy)methyl]hexahydro-6,7-dihydroxy-3-(2-hydroxyphenyl)- InChI=1/C19H25NO12/c21-5-9-11(23)13(25)15(27)18(31-9)29-6-10-12(24)14(26)16-17(30-10)20(19(28)32-16)7-3-1-2-4-8(7)22/h1-4,9-18,21-27H,5-6H2 UQUJYJFBLXCVJV-UHFFFAOYAM 1-(2-Hydroxyphenylamino)-1-deoxy-β-gentiobioside 1,2-carbamate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-Hydroxy-1-methyl-9,10-dioxo-2-(3-oxo-butyl)-1,2,9,10-tetrahydro-anthracene-1-carbaldehyde rel-(1R,2R)-7-hydroxy-1-methyl-9,10-dioxo-2-(3-oxobutyl)-1,2,9,10-tetrahydroanthracene-1-carbaldehyde 1-anthracenecarboxaldehyde, 1,2,9,10-tetrahydro-7-hydroxy-1-methyl-9,10-dioxo-2-(3-oxobutyl)-, (1S,2S)- InChI=1/C20H18O5/c1-11(22)3-4-12-5-7-15-17(20(12,2)10-21)19(25)16-9-13(23)6-8-14(16)18(15)24/h5-10,12,23H,3-4H2,1-2H3/t12-,20-/m0/s1 DLOKNSHPNFRFJA-YUNKPMOVBH Sterekunthal A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(3aR,4R,4a'S,5'R,7'S,7aR,9a'S)-5'-hydroxy-3-methoxy-7a-methyl-8'-methylenedecahydro-1H-spiro[2-benzofuran-4,4'-[7,9a]methanocyclohepta[c]pyran]-1',9'(4a'H)-dione 3-buten-2-one, 4-[(1S,4R,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl]-, (3E)- InChI=1/C21H28O6/c1-11-12-7-13(22)14-20(10-27-18(24)21(14,8-12)16(11)23)6-4-5-19(2)9-26-17(25-3)15(19)20/h12-15,17,22H,1,4-10H2,2-3H3/t12-,13-,14+,15-,17?,19+,20-,21+/m1/s1 OCIBRRBOOBNKJY-CQVBDWECBC 11α-Hydroxy-6α-methoxy-6,19-epoxy-6,7-seco-ent-kaur-16-en-15-one-7,20-olide 6-Epiangustifolin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-3-[(3R,4R)-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbin-3-yl]propanoic acid 3-phorbinepropanoic acid, 9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-, (3S,4S)- InChI=1/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36,39H,1,9-11H2,2-7H3,(H,40,41)/b22-12-,23-13-,24-12-,25-14-,26-13-,27-14-, NSFSLUUZQIAOOX-NEUGORDIBQ 13-epi-Phaeophorbide-a . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(4-Hydroxy-2,2,6-trimethyl-7-oxa-bicyclo[4.1.0]hept-1-yl)-but-3-en-2-one rel-(3E)-4-[(1R,4S,6S)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl]but-3-en-2-one 3-buten-2-one, 4-[(1S,4R,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl]-, (3E)- InChI=1/C13H20O3/c1-9(14)5-6-13-11(2,3)7-10(15)8-12(13,4)16-13/h5-6,10,15H,7-8H2,1-4H3/b6-5+/t10-,12-,13+/m1/s1 VYKLRWGPNUVKNC-BJEXPOHKBQ 3β-Hydroxy-5α,6α-epoxy-7-megastigmen-9-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(3beta,8xi,9xi,14xi,16xi,17xi)-spirosol-5-en-3-yl 6-deoxyhexopyranosyl-(1->2)-[pentopyranosyl-(1->2)-6-deoxyhexopyranosyl-(1->4)]hexopyranoside hexopyranoside, (3beta,8xi,9xi,14xi,16xi,17xi)-spirosol-5-en-3-yl O--6-deoxyhexopyranosyl-(1->2)-O-[O-pentopyranosyl-(1->2)-6-deoxyhexopyranosyl-(1->4)]- InChI=1/C50H81NO19/c1-20-9-14-50(51-17-20)21(2)32-30(70-50)16-28-26-8-7-24-15-25(10-12-48(24,5)27(26)11-13-49(28,32)6)65-47-43(69-45-39(60)36(57)33(54)22(3)63-45)40(61)41(31(18-52)66-47)67-46-42(37(58)34(55)23(4)64-46)68-44-38(59)35(56)29(53)19-62-44/h7, RMXBEFPNQXHZDG-PNNPTPRBBI (25S)-3β-{O-α-L-rhamnopyranosyl-(1→2)-[O-β-D-xylopyranosyl-(1→2)-O-α-L-rhamnopyranosyl-(1→4)]-β-D-galactopyranosyloxy}-22βN-spirosol-5-ene Solaculine A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-Hydroxy-2-(3-hydroxy-4-methoxy-phenyl)-8,8-dimethyl-2,3-dihydro-8H-pyrano[2,3-f]chromen-4-one 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-8,8-dimethyl-2,3-dihydro-4H,8H-pyrano[2,3-f]chromen-4-one 2H-pyran, 2,2-dimethyl-6-(1-methylethenyl)- InChI=1/C21H20O6/c1-21(2)7-6-12-18(27-21)10-15(24)19-14(23)9-17(26-20(12)19)11-4-5-16(25-3)13(22)8-11/h4-8,10,17,22,24H,9H2,1-3H3/t17-/m0/s1 IAYOSEMOKOQXBK-KRWDZBQOBQ (-)-(2S)-5,3'-Dihydroxy-4'-methoxy-6'',6''-dimethylchromeno-(7,8,2'',3'')-flavanone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,9,9a-Trimethyl-3a,4,5,7,8,9,9a,9b-octahydro-3H-naphtho[1,2-b]furan-2-one rel-(3R,3aR,9S,9aR,9bS)-3,9,9a-trimethyl-3a,4,5,7,8,9,9a,9b-octahydronaphtho[1,2-b]furan-2(3H)-one naphtho[1,2-b]furan-2(3H)-one, 3a,4,5,7,8,9,9a,9b-octahydro-3,9,9a-trimethyl-, (3aR,9S,9aR,9bS)- InChI=1/C15H22O2/c1-9-5-4-6-11-7-8-12-10(2)14(16)17-13(12)15(9,11)3/h6,9-10,12-13H,4-5,7-8H2,1-3H3/t9-,10+,12+,13-,15+/m0/s1 PDQLBZJQPLHGHY-DHLXWNJQBM 5-Epidilatanolide A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,2-Dimethoxy-4-[2-(3-methoxy-phenyl)-ethyl]-benzene 1,2-dimethoxy-4-[2-(3-methoxyphenyl)ethyl]benzene benzene, 1,2-dimethoxy-4-[2-(3-methoxyphenyl)ethyl]- InChI=1/C17H20O3/c1-18-15-6-4-5-13(11-15)7-8-14-9-10-16(19-2)17(12-14)20-3/h4-6,9-12H,7-8H2,1-3H3 HBUJATCJXGLELF-UHFFFAOYAO 3,3',4-Trimethoxybibenzyl . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,4,5-Trihydroxy-benzoic acid 6-(cyano-phenyl-methoxy)-3,4,5-trihydroxy-tetrahydro-pyran-2-ylmethyl ester phenyl{[6-O-(3,4,5-trihydroxybenzoyl)hexopyranosyl]oxy}acetonitrile benzeneacetonitrile, alpha-[[6-O-(3,4,5-trihydroxybenzoyl)hexopyranosyl]oxy]-, (alphaR)- InChI=1/C21H21NO10/c22-8-14(10-4-2-1-3-5-10)31-21-19(28)18(27)17(26)15(32-21)9-30-20(29)11-6-12(23)16(25)13(24)7-11/h1-7,14-15,17-19,21,23-28H,9H2/t14-,15?,17?,18?,19?,21?/m0/s1 BYILEHCAHZEAIX-NDYOKGLIBT 6'-O-Galloylprunasin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
[3-Methyl-2-(3-methyl-but-2-enyl)-6-phenyl-cyclohex-3-enyl]-(2,4,6-trihydroxy-phenyl)-methanone rel-[(1R,2S,6R)-3-methyl-2-(3-methylbut-2-en-1-yl)-6-phenylcyclohex-3-en-1-yl](2,4,6-trihydroxyphenyl)methanone methanone, [(1R,2S,6R)-3-methyl-2-(3-methyl-2-butenyl)-6-phenyl-3-cyclohexen-1-yl](2,4,6-trihydroxyphenyl)- InChI=1/C25H28O4/c1-15(2)9-11-19-16(3)10-12-20(17-7-5-4-6-8-17)23(19)25(29)24-21(27)13-18(26)14-22(24)28/h4-10,13-14,19-20,23,26-28H,11-12H2,1-3H3/t19-,20+,23-/m1/s1 AYPOOQWQTQIRFW-ZRCGQRJVBB (-)-(2,4,6-Trihydroxyphenyl)[3'-methyl-2'-(3''-methylbut-2''-enyl)-6'-phenylcyclohex-3'-enyl]methanone (-)-Hydroxypanduratin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 15-hydroxy-4,8,10,14-tetramethyl-3-oxo-2,3,4,5,6,7,8,9,10,11,12,13,14,15-tetradecahydro-1H-cyclopenta[a]phenanthren-4-ylmethyl ester [(4alpha,5alpha,15alpha)-15-hydroxy-4,8,10,14-tetramethyl-3-oxogon-16-en-4-yl]methyl acetate gon-16-en-3-one, 4-[(acetyloxy)methyl]-15-hydroxy-4,8,10,14-tetramethyl-, (4alpha,5alpha,15alpha)- InChI=1/C24H36O4/c1-15(25)28-14-22(3)17-10-13-23(4)18(21(17,2)12-11-19(22)26)8-6-16-7-9-20(27)24(16,23)5/h7,9,16-18,20,27H,6,8,10-14H2,1-5H3/t16-,17-,18-,20+,21+,22+,23-,24+/m1/s1 DLHMIGHUNOKCMU-XRMRWFDOBY 28-Acetoxy-15α-hydroxymansumbinone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,5,8a-Trimethyl-4a,5,8a,9-tetrahydro-4H-naphtho[2,3-b]furan-8-one rel-(4aR,5S,8aS)-3,5,8a-trimethyl-4a,5,8a,9-tetrahydronaphtho[2,3-b]furan-8(4H)-one naphtho[2,3-b]furan-8(4H)-one, 4a,5,8a,9-tetrahydro-3,5,8a-trimethyl-, (4aS,5R,8aR)- InChI=1/C15H18O2/c1-9-4-5-14(16)15(3)7-13-11(6-12(9)15)10(2)8-17-13/h4-5,8-9,12H,6-7H2,1-3H3/t9-,12+,15-/m1/s1 IDGRBNKTZISWPG-MURWCNHIBA 4aαH-3,5α,8aβ-Trimethyl-4,4a,8a,9-tetrahydro-naphtho[2,3-b]-furan-8-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
{(1R,2S,4aR,5R,6S,7R,8R,8aR)-8-(acetyloxy)-5-[2-(3-furyl)ethyl]-2,7-dihydroxy-5,6-dimethyloctahydro-8aH-spiro[naphthalene-1,2'-oxiran]-8a-yl}methyl rel-acetate spiro[naphthalene-1(2H),2'-oxirane]-2,7,8-triol, 8a-[(acetyloxy)methyl]-5-[2-(3-furanyl)ethyl]octahydro-5,6-dimethyl-, 8-acetate, (1R,2S,4aR,5R,6S,7R,8R,8aR)- InChI=1/C24H34O8/c1-14-20(28)21(32-16(3)26)23(12-30-15(2)25)18(5-6-19(27)24(23)13-31-24)22(14,4)9-7-17-8-10-29-11-17/h8,10-11,14,18-21,27-28H,5-7,9,12-13H2,1-4H3/t14-,18-,19+,20-,21+,22+,23+,24-/m1/s1 RGEIXNHVBDLHCF-HYDHIAQQBF 3β,7β-Dihydroxy-4α,18;15,16-diepoxy-6α,19-diacetoxy-neo-cleroda-13(16),14-diene Teucrolin F . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 5-[13-(2-acetoxy-5-hydroxy-4-methyl-3,6-dioxo-cyclohexa-1,4-dienyl)-tridecyl]-4-hydroxy-2-methyl-3,6-dioxo-cyclohexa-1,4-dienyl ester 2-{13-[5-(acetyloxy)-2-hydroxy-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl]tridecyl}-4-hydroxy-5-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl acetate 2,5-cyclohexadiene-1,4-dione, 2-(acetyloxy)-6-[13-[2-(acetyloxy)-5-hydroxy-4-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl]tridecyl]-5-hydroxy-3-methyl- InChI=1/C31H40O10/c1-18-24(34)28(38)23(31(26(18)36)41-21(4)33)17-15-13-11-9-7-5-6-8-10-12-14-16-22-27(37)25(35)19(2)30(29(22)39)40-20(3)32/h34,37H,5-17H2,1-4H3 AVPDKIQZUGDDMG-UHFFFAOYAH Ardisiaquinone G . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Hydroxy-3-methyl-hepta-2,4-dienoic acid [5-(6-hydroxy-3-methyl-hepta-2,4-dienoylamino)-2,2,4,4-tetramethyl-3-oxo-pentyl]-amide (2E,4E,2'E,4'E)-N,N'-(2,2,4,4-tetramethyl-3-oxopentane-1,5-diyl)bis(6-hydroxy-3-methylhepta-2,4-dienamide) 2,4-heptadienamide, N,N'-(2,2,4,4-tetramethyl-3-oxo-1,5-pentanediyl)bis[6-hydroxy-3-methyl-, (2E,4E,2'E,4'E)- InChI=1/C25H40N2O5/c1-17(9-11-19(3)28)13-21(30)26-15-24(5,6)23(32)25(7,8)16-27-22(31)14-18(2)10-12-20(4)29/h9-14,19-20,28-29H,15-16H2,1-8H3,(H,26,30)(H,27,31)/b11-9+,12-10+,17-13+,18-14+ QWDUIMTWTQIEFM-CYOBFCGTBB Arboreumine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Benzoic acid 5-acetoxy-1,2,6-trihydroxy-cyclohex-3-enylmethyl ester [(1R,2S,5R,6S)-5-(acetyloxy)-1,2,6-trihydroxycyclohex-3-en-1-yl]methyl rel-benzoate 5-cyclohexene-1,2,3,4-tetrol, 2-[(benzoyloxy)methyl]-, 4-acetate, (1S,2R,3S,4R)- InChI=1/C16H18O7/c1-10(17)23-12-7-8-13(18)16(21,14(12)19)9-22-15(20)11-5-3-2-4-6-11/h2-8,12-14,18-19,21H,9H2,1H3/t12-,13+,14+,16-/m1/s1 ADEXVVHMWRYPCI-ORIJERBGBB Ellipeiopsol A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-Benzo[1,3]dioxol-5-yl-1-pyrrolidin-1-yl-penta-2,4-dien-1-one 1-[(2E,4Z)-5-(1,3-benzodioxol-5-yl)penta-2,4-dienoyl]pyrrolidine pyrrolidine, 1-[(2E,4Z)-5-(1,3-benzodioxol-5-yl)-1-oxo-2,4-pentadienyl]- InChI=1/C16H17NO3/c18-16(17-9-3-4-10-17)6-2-1-5-13-7-8-14-15(11-13)20-12-19-14/h1-2,5-8,11H,3-4,9-10,12H2/b5-1-,6-2+ GQIJYUMTOUBHSH-SOSXVSKCBB N-[10-(13,14-Methylenedioxyphenyl)-7(E),9(Z)-pentadienoyl]-pyrrolidine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,3'-(6Z)-tetradec-6-ene-1,14-diyldibenzene-1,2-diol 1,2-benzenediol, 3,3'-[(6Z)-6-tetradecene-1,14-diyl]bis- InChI=1/C26H36O4/c27-23-19-13-17-21(25(23)29)15-11-9-7-5-3-1-2-4-6-8-10-12-16-22-18-14-20-24(28)26(22)30/h1,3,13-14,17-20,27-30H,2,4-12,15-16H2/b3-1- NAKZWEKDEOZWPV-IWQZZHSRBO 1,2-dihydroxy-3-[14-(2,3-dihydroxyphenyl)-(Z)-tetradec-6-enyl]benzene Gerronemin D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-{2-[4,5-Dihydroxy-6-hydroxymethyl-2-(2-methyl-4-oxo-4H-pyran-3-yloxy)-tetrahydro-pyran-3-yloxy]-3-hydroxy-3-methyl-butoxy}-furo[3,2-g]chromen-7-one 2-methyl-4-oxo-4H-pyran-3-yl 2-O-(2-hydroxy-2-methyl-1-{[(7-oxo-7H-furo[3,2-g]chromen-4-yl)oxy]methyl}propyl)hexopyranoside hexopyranoside, 2-methyl-4-oxo-4H-pyran-3-yl 2-O-[2-hydroxy-2-methyl-1-[[(7-oxo-7H-furo[3,2-g][1]benzopyran-4-yl)oxy]methyl]propyl]- InChI=1/C28H30O13/c1-13-24(16(30)7-9-35-13)41-27-26(23(33)22(32)19(11-29)39-27)40-20(28(2,3)34)12-37-25-14-4-5-21(31)38-18(14)10-17-15(25)6-8-36-17/h4-10,19-20,22-23,26-27,29,32-34H,11-12H2,1-3H3 ISXGHEKJMRQGFQ-UHFFFAOYAG Pabularin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(4aR,5R,6R,10bS)-6-hydroxy-9a-isopropyl-4,4,7-trimethyl-2,3,4,4a,5,6,6b,9a-octahydro-1H-5,10b-(epoxymethano)pentaleno[2,1-a]naphthalene-9,10,11-trione 1H-5,10b-(epoxymethano)pentaleno[2,1-a]naphthalene-9,10,11-trione, 2,3,4,4a,5,6,6b,9a-octahydro-6-hydroxy-4,4,7-trimethyl-9a-(1-methylethyl)-, (4aS,5S,6S,10bR)- InChI=1/C23H28O5/c1-10(2)23-12(24)9-11(3)14(23)13-15(19(23)26)22-8-6-7-21(4,5)18(22)17(16(13)25)28-20(22)27/h9-10,14,16-18,25H,6-8H2,1-5H3/t14?,16-,17+,18-,22-,23?/m0/s1 IEPYKUBVROCHOQ-RQMWKYGDBR rel-(5S,6S,7S,10R,12S,13R)-7-Hydroxyapiana-8,14-diene-11,16-dion-(22,6)-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-{4-[2-Hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-1-hydroxymethyl-ethoxy]-3-methoxy-phenyl}-N-[2-(4-hydroxy-phenyl)-ethyl]-acrylamide rel-(2E)-3-(4-{[(1R,2R)-2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethyl]oxy}-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]acrylamide 2-propenamide, 3-[4-[[(1S,2S)-2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethyl]oxy]-3-methoxyphenyl]-N-[2-(4-hydroxyphenyl)ethyl]-, (2E)- InChI=1/C28H31NO8/c1-35-24-16-20(7-10-22(24)32)28(34)26(17-30)37-23-11-5-19(15-25(23)36-2)6-12-27(33)29-14-13-18-3-8-21(31)9-4-18/h3-12,15-16,26,28,30-32,34H,13-14,17H2,1-2H3,(H,29,33)/b12-6+/t26-,28-/m0/s1 PJAFJMNWVUKNOR-MGBVTPAKBU Erythro-1-(4-hydroxy-3-methoxyphenyl)-2-{4-{2-[N-2-(4-hydroxyphenyl)ethyl]carbamoylethenyl-2-methoxyphenoxyl}}-1,3-propanodiol Erythro-canabisine H . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(3,8-Dimethyl-naphthalen-2-yloxy)-6-hydroxymethyl-tetrahydro-pyran-3,4,5-triol 3,8-dimethyl-2-naphthyl hexopyranoside hexopyranoside, 3,8-dimethyl-2-naphthalenyl InChI=1/C18H22O6/c1-9-4-3-5-11-6-10(2)13(7-12(9)11)23-18-17(22)16(21)15(20)14(8-19)24-18/h3-7,14-22H,8H2,1-2H3 WPJSPXRWMUIWMW-UHFFFAOYAA 2,5-Dimethyl-3-O-β-D-glucopyranosylnaphthol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,5,8-Trihydroxy-3-(3-methyl-but-2-enyl)-[1,4]naphthoquinone 2,5,8-trihydroxy-3-(3-methylbut-2-en-1-yl)naphthoquinone 1,4-naphthalenedione, 2,5,8-trihydroxy-3-(3-methyl-2-butenyl)- InChI=1/C15H14O5/c1-7(2)3-4-8-13(18)11-9(16)5-6-10(17)12(11)15(20)14(8)19/h3,5-6,16-17,19H,4H2,1-2H3 KNOSIOWNDGUGFJ-UHFFFAOYAQ 2,5,8-Trihydroxy-3-(3-methyl-2-butenyl)-1,4-naphthoquinone Hydroxysesamone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,7-Dihydroxy-2-[3-hydroxy-4-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-phenyl]-5-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-chromen-4-one 4-[5-(hexopyranosyloxy)-3,7-dihydroxy-4-oxo-4H-chromen-2-yl]-2-hydroxyphenyl hexopyranoside 4H-1-benzopyran-4-one, 5-(hexopyranosyloxy)-2-[4-(hexopyranosyloxy)-3-hydroxyphenyl]-3,7-dihydroxy- InChI=1/C27H30O17/c28-6-14-17(32)20(35)23(38)26(43-14)41-11-2-1-8(3-10(11)31)25-22(37)19(34)16-12(40-25)4-9(30)5-13(16)42-27-24(39)21(36)18(33)15(7-29)44-27/h1-5,14-15,17-18,20-21,23-24,26-33,35-39H,6-7H2 ZANFLRJWKPZOAS-UHFFFAOYAB Quercetin 5,4'-di-O-β-D-glucopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-[2-Hydroxy-4-methoxy-6-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-phenyl]-3-(4-hydroxy-phenyl)-propan-1-one 3-hydroxy-2-[3-(4-hydroxyphenyl)propanoyl]-5-methoxyphenyl hexopyranoside 1-propanone, 1-[2-(hexopyranosyloxy)-6-hydroxy-4-methoxyphenyl]-3-(4-hydroxyphenyl)- InChI=1/C22H26O10/c1-30-13-8-15(26)18(14(25)7-4-11-2-5-12(24)6-3-11)16(9-13)31-22-21(29)20(28)19(27)17(10-23)32-22/h2-3,5-6,8-9,17,19-24,26-29H,4,7,10H2,1H3 PQCIBORQLVRFMR-UHFFFAOYAJ 2',4-Dihydroxy-4'-methoxy-6'-O-(β-glucopyranoside) dihydrochalcone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Isopropyl-8a-methyl-4-methylene-octahydro-naphthalene-1,4a-diol rel-(1R,4aR,6R,8aS)-6-isopropyl-8a-methyl-4-methyleneoctahydronaphthalene-1,4a(2H)-diol 1,4a(2H)-naphthalenediol, octahydro-8a-methyl-4-methylene-6-(1-methylethyl)-, (1S,4aS,6S,8aR)- InChI=1/C15H26O2/c1-10(2)12-7-8-14(4)13(16)6-5-11(3)15(14,17)9-12/h10,12-13,16-17H,3,5-9H2,1-2,4H3/t12-,13-,14+,15-/m0/s1 CKGNGZNSTIOFOY-XQLPTFJDBE (-)-1S,5R,7R,10R-Eudesm-4(14)-en-1α,5β-diol Verticillatol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(3-Methyl-but-2-enyl)-6H-benzo[4,5]furo[3,2-c]chromene-3,9-diol 4-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c]chromene-3,9-diol 6H-benzofuro[3,2-c][1]benzopyran-3,9-diol, 4-(3-methyl-2-butenyl)- InChI=1/C20H18O4/c1-11(2)3-5-14-17(22)8-7-15-19(14)23-10-16-13-6-4-12(21)9-18(13)24-20(15)16/h3-4,6-9,21-22H,5,10H2,1-2H3 VREXGHBHPUSDKC-UHFFFAOYAB 3,9-Dihydroxy-4-(γ,γ-dimethylallyl)pterocarpene Erypoegin E . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-{(Z)-2-[3-(hexopyranosyloxy)-5-hydroxyphenyl]vinyl}phenyl hexopyranoside hexopyranoside, 4-[(Z)-2-[3-(hexopyranosyloxy)-5-hydroxyphenyl]ethenyl]phenyl InChI=1/C26H32O13/c27-10-17-19(30)21(32)23(34)25(38-17)36-15-5-3-12(4-6-15)1-2-13-7-14(29)9-16(8-13)37-26-24(35)22(33)20(31)18(11-28)39-26/h1-9,17-35H,10-11H2/b2-1- YGQPMDDXSJHKJT-UPHRSURJBT cis-Resveratrol-3,4'-O-β-diglucoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,8,10-Trihydroxy-9-(3-hydroxy-3-methyl-butyl)-3,3-dimethyl-11-(3-methyl-but-2-enyl)-3H-4,12,13-trioxa-dibenzo[a,h]fluoren-7-one 5,8,10-trihydroxy-9-(3-hydroxy-3-methylbutyl)-3,3-dimethyl-11-(3-methylbut-2-en-1-yl)-3H,7H-chromeno[6',5':4,5]furo[2,3-b]chromen-7-one (non-preferred name) 3H,7H-pyrano[2',3':6,7]benzofuro[2,3-b][1]benzopyran-7-one, 5,8,10-trihydroxy-9-(3-hydroxy-3-methylbutyl)-3,3-dimethyl-11-(3-methyl-2-butenyl)- InChI=1/C30H32O8/c1-14(2)7-8-16-22(32)15(9-11-29(3,4)35)23(33)21-24(34)20-18-13-19(31)26-17(10-12-30(5,6)38-26)25(18)36-28(20)37-27(16)21/h7,10,12-13,31-33,35H,8-9,11H2,1-6H3 GNZLRTYZJULUCG-UHFFFAOYAR 5,7,5'-Trihydroxy-6-(3-hydroxy-3-methylbutyl)-8-(γ,γ-dimethylallyl)-[6'''',6''''-dimethylpyrano-(2'''',3'''':4',3')]-coumaronochromone Formosanatin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,7-Dihydroxy-2',2'-dimethyl-8-(3-methyl-but-2-enyl)-2,3,3',4'-tetrahydro-2'H-[2,6']bichromenyl-4-one 5,7-dihydroxy-2',2'-dimethyl-8-(3-methylbut-2-en-1-yl)-2,3,3',4'-tetrahydro-2'H,4H-2,6'-bichromen-4-one [2,6'-bi-2H-1-benzopyran]-4(3H)-one, 3',4'-dihydro-5,7-dihydroxy-2',2'-dimethyl-8-(3-methyl-2-butenyl)-, (2S)- InChI=1/C25H28O5/c1-14(2)5-7-17-18(26)12-19(27)23-20(28)13-22(29-24(17)23)15-6-8-21-16(11-15)9-10-25(3,4)30-21/h5-6,8,11-12,22,26-27H,7,9-10,13H2,1-4H3/t22-/m0/s1 UUJGHXKKHDPLPR-QFIPXVFZBP (2S)-5,7-Dihydroxy-8-(γ,γ-dimethylallyl)-[6''',6'''-dimethyl-4''',5'''-dihydropyrano-(2''',3''':4',3')]-flavanone Euchrenone a16 . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Bromo-2-(3-bromo-propa-1,2-dienyl)-5-ethyl-2,3,3a,5,6,7,10,10a-octahydro-furo[3,2-b]oxonine rel-(2R,3aR,5R,6S,8Z,10aR)-6-bromo-2-[(1S)-3-bromopropa-1,2-dien-1-yl]-5-ethyl-2,3,3a,5,6,7,10,10a-octahydrofuro[3,2-b]oxonine furo[3,2-b]oxonin, 6-bromo-2-[(1R)-3-bromo-1,2-propadienyl]-5-ethyl-2,3,3a,5,6,7,10,10a-octahydro-, (2R,3aR,5R,6S,8Z,10aR)- InChI=1/C15H20Br2O2/c1-2-13-12(17)7-3-4-8-14-15(19-13)10-11(18-14)6-5-9-16/h3-4,6,9,11-15H,2,7-8,10H2,1H3/b4-3-/t5-,11+,12+,13-,14-,15-/m1/s1 MFIOGNKPHIMUQN-OKEVTEFJBP Itomanallene A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-Bromo-2-isopropyl-4a,8-dimethyl-1,2,3,4,4a,5,6,8a-octahydro-naphthalen-1-ol rel-(1R,2S,4aS,5S,8aR)-5-bromo-2-isopropyl-4a,8-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-ol 1-naphthalenol, 5-bromo-1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethyl)-, (1S,2R,4aR,5R,8aS)- InChI=1/C15H25BrO/c1-9(2)11-7-8-15(4)12(16)6-5-10(3)13(15)14(11)17/h5,9,11-14,17H,6-8H2,1-4H3/t11-,12-,13-,14+,15+/m1/s1 POKIILKOWQTYGN-ZSAUSMIDBG Itomanol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(6aR,7S,8S,11S)-5,6a,7,8,9,11-hexahydro-6,11-methanobenzo[b][1,3]benzodioxolo[5,6-e]azepine-7,8-diol 6,11-methano-6H-benzo[b]-1,3-benzodioxolo[5,6-e]azepine-7,8-diol, 5,6a,7,8,9,11-hexahydro-, (6aR,7S,8S,11S)- InChI=1/C16H17NO4/c18-12-2-1-9-11-6-17(15(9)16(12)19)5-8-3-13-14(4-10(8)11)21-7-20-13/h1,3-4,11-12,15-16,18-19H,2,5-7H2/t11-,12+,15-,16-/m1/s1 SZJIAQIHDKIFGC-NOXHYTERBO Nangustine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(4-Hydroxy-phenyl)-acrylic acid 6-[2-(3,4-dihydroxy-phenyl)-5-hydroxy-4-oxo-7-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-4H-chromen-3-yloxy]-3,4,5-trihydroxy-tetrahydro-pyran-2-ylmethyl ester 2-(3,4-dihydroxyphenyl)-5-hydroxy-3-({6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]hexopyranosyl}oxy)-4-oxo-4H-chromen-7-yl hexopyranoside 4H-1-benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-7-(hexopyranosyloxy)-5-hydroxy-3-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]hexopyranosyl]oxy]- InChI=1/C36H36O19/c37-12-22-26(43)29(46)31(48)35(53-22)51-17-10-20(41)25-21(11-17)52-33(15-4-7-18(39)19(40)9-15)34(28(25)45)55-36-32(49)30(47)27(44)23(54-36)13-50-24(42)8-3-14-1-5-16(38)6-2-14/h1-11,22-23,26-27,29-32,35-41,43-44,46-49H,12-13H2/b8-3+ VASHBWYFPVZWGX-FPYGCLRLBX Quercetin 3-O-β-(6''-E-p-coumaroylglucopyranoside)-7-O-β-glucopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
11-Hydroxymethyl-4,4,6a,6b,8a,12,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,12,12a,12b,13,14,14a,14b-icosahydro-picen-3-ol (3beta,5xi,9xi,13xi,18xi,19alpha)-urs-20-ene-3,30-diol urs-20-ene-3,30-diol, (3beta,5xi,9xi,13xi,18xi,19alpha)- InChI=1/C30H50O2/c1-19-20(18-31)10-13-27(4)16-17-29(6)21(25(19)27)8-9-23-28(5)14-12-24(32)26(2,3)22(28)11-15-30(23,29)7/h10,19,21-25,31-32H,8-9,11-18H2,1-7H3/t19-,21?,22?,23?,24+,25?,27-,28+,29-,30-/m1/s1 XWMZFWRQXGPSQQ-MFDLCYMUBZ Taraxast-20-ene-3β,30-diol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,8-Dihydroxy-3,8a-bis-hydroxymethyl-5-methyl-3a,8a,9,9a-tetrahydro-3H-naphtho[2,3-b]furan-2-one rel-(3R,3aR,8aS,9aR)-3,8-dihydroxy-3,8a-bis(hydroxymethyl)-5-methyl-3a,8a,9,9a-tetrahydronaphtho[2,3-b]furan-2(3H)-one naphtho[2,3-b]furan-2(3H)-one, 3a,8a,9,9a-tetrahydro-3,8-dihydroxy-3,8a-bis(hydroxymethyl)-5-methyl-, (3S,3aS,8aR,9aS)- InChI=1/C15H18O6/c1-8-2-3-12(18)14(6-16)5-11-10(4-9(8)14)15(20,7-17)13(19)21-11/h2-4,10-11,16-18,20H,5-7H2,1H3/t10-,11-,14-,15+/m0/s1 OIIRJSNFKWXNDR-LWWSYDQCBW Macrophyllilactone G . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,2-Dihydroxy-anthraquinone 1,2-dihydroxyanthra-9,10-quinone 9,10-anthracenedione, 1,2-dihydroxy- InChI=1/C14H8O4/c15-10-6-5-9-11(14(10)18)13(17)8-4-2-1-3-7(8)12(9)16/h1-6,15,18H RGCKGOZRHPZPFP-UHFFFAOYAG 1,2-Dihydroxy-9,10-anthracenedione Alizarin Hystazarin . Information we have got: NMR spectra 13C, 13C, 1H, 3D coordinates, File formats: CML, mol, png, jpeg
9b-Hydroxy-7,9a-dimethyl-6-methylene-5,5a,6,7,8,9,9a,9b-octahydro-1H-naphtho[1,2-c]furan-3-one rel-(9aR,9bR)-9b-hydroxy-7,9a-dimethyl-6-methylene-5,5a,6,7,8,9,9a,9b-octahydronaphtho[1,2-c]furan-3(1H)-one naphtho[1,2-c]furan-3(1H)-one, 5,5a,6,7,8,9,9a,9b-octahydro-9b-hydroxy-7,9a-dimethyl-6-methylene-, (9aS,9bS)- InChI=1/C15H20O3/c1-9-6-7-14(3)11(10(9)2)4-5-12-13(16)18-8-15(12,14)17/h5,9,11,17H,2,4,6-8H2,1,3H3/t9?,11?,14-,15+/m0/s1 OUBGLUCJLDERNN-VOKLHHQWBS Salutarisolide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(3,4-dihydroxyphenyl)-5-hydroxy-3,6-dimethoxy-4-oxo-4H-chromen-7-yl sulfate 4H-1-benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,6-dimethoxy-7-(sulfooxy)-, ion(1-) InChI=1/C17H14O11S/c1-25-16-11(28-29(22,23)24)6-10-12(13(16)20)14(21)17(26-2)15(27-10)7-3-4-8(18)9(19)5-7/h3-6,18-20H,1-2H3,(H,22,23,24)/p-1 AYBWPCJLKMIOED-REWHXWOFAS Centaradixin . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-Methoxy-3-(2,3,4-trimethoxy-6-methoxycarbonyl-phenyl)-phenazine-2-carboxylic acid methyl ester methyl 4-methoxy-3-[2,3,4-trimethoxy-6-(methoxycarbonyl)phenyl]phenazine-2-carboxylate 2-phenazinecarboxylic acid, 4-methoxy-3-[2,3,4-trimethoxy-6-(methoxycarbonyl)phenyl]-, methyl ester InChI=1/C26H24N2O8/c1-31-18-12-14(26(30)36-6)20(24(34-4)22(18)32-2)19-13(25(29)35-5)11-17-21(23(19)33-3)28-16-10-8-7-9-15(16)27-17/h7-12H,1-6H3 KSVHVKISJJXWGE-UHFFFAOYAX (S)-Methyl 4-methoxy 3-(4,5,6-trimethoxy-2-methoxycarbonylphenyl)phenazine-2-carboxylate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-(2,8-Dihydroxy-1,2,6-trimethyl-1,2,6,7,8,8a-hexahydro-naphthalen-1-yl)-3-hydroxy-propan-1-one rel-1-[(1R,2R,6S,8S,8aS)-2,8-dihydroxy-1,2,6-trimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3-hydroxypropan-1-one 1-propanone, 1-[(1R,2R,6S,8S,8aS)-1,2,6,7,8,8a-hexahydro-2,8-dihydroxy-1,2,6-trimethyl-1-naphthalenyl]-3-hydroxy- InChI=1/C16H24O4/c1-10-8-11-4-6-15(2,20)16(3,13(19)5-7-17)14(11)12(18)9-10/h4,6,8,10,12,14,17-18,20H,5,7,9H2,1-3H3/t10-,12+,14-,15-,16-/m1/s1 KPUOKNHMWKNLJE-LIDJKPORBR 1-(2,8-Dihydroxy-1,2,6-trimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl)-3-hydroxy-1-propanone Decumbenone A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-Acetyl-8-hydroxy-naphtho[2,3-c]furan-4,9-dione 1-acetyl-8-hydroxynaphtho[2,3-c]furan-4,9-dione naphtho[2,3-c]furan-4,9-dione, 1-acetyl-8-hydroxy- InChI=1/C14H8O5/c1-6(15)14-11-8(5-19-14)12(17)7-3-2-4-9(16)10(7)13(11)18/h2-5,16H,1H3 DKTNOXJBGNDAGS-UHFFFAOYAH 1-Acetyl-8-hydroxynaphtho[2,3-c]furan-4,9-dione Arthoniafurone A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,3-Dihydroxy-1-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-cyclopentanecarbonitrile 1-(hexopyranosyloxy)-2,3-dihydroxycyclopentanecarbonitrile cyclopentanecarbonitrile, 1-(hexopyranosyloxy)-2,3-dihydroxy- InChI=1/C12H19NO8/c13-4-12(2-1-5(15)10(12)19)21-11-9(18)8(17)7(16)6(3-14)20-11/h5-11,14-19H,1-3H2 GVFAYMLCFVOLFT-UHFFFAOYAF 1-(β-D-glucopyranosyloxy)-2,3-dihydroxycyclopentane-1-carbonitrile Passiguatemalin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-Hydroxy-7-methylsulfanylcarbonyloxymethyl-1-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-1,4a,5,7a-tetrahydro-cyclopenta[c]pyran-4-carboxylic acid methyl ester methyl rel-(1R,5R)-1-(hexopyranosyloxy)-5-hydroxy-7-({[(methylthio)carbonyl]oxy}methyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate cyclopenta[c]pyran-4-carboxylic acid, 1-(hexopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxy-7-[[[(methylthio)carbonyl]oxy]methyl]-, methyl ester, (1S,5S)- InChI=1/C19H26O12S/c1-27-16(25)8-6-28-17(31-18-15(24)14(23)13(22)10(4-20)30-18)11-7(3-9(21)12(8)11)5-29-19(26)32-2/h3,6,9-15,17-18,20-24H,4-5H2,1-2H3/t9-,10?,11?,12?,13?,14?,15?,17-,18?/m0/s1 JNDNZIPLLDTLQK-FMXIBMNABH Paederosidic acid methyl ester . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Methyl-but-2-enoic acid 3-acetoxymethyl-6,10-dimethyl-2-oxo-2,4,5,8,9,11a-hexahydro-cyclodeca[b]furan-9-yl ester (6E,9R,10E,11aS)-3-[(acetyloxy)methyl]-6,10-dimethyl-2-oxo-2,4,5,8,9,11a-hexahydrocyclodeca[b]furan-9-yl rel-(2E)-2-methylbut-2-enoate 2-butenoic acid, 2-methyl-, (6E,9S,10E,11aR)-3-[(acetyloxy)methyl]-2,4,5,8,9,11a-hexahydro-6,10-dimethyl-2-oxocyclodeca[b]furan-9-yl ester, (2E)- InChI=1/C22H28O6/c1-6-14(3)21(24)27-19-10-8-13(2)7-9-17-18(12-26-16(5)23)22(25)28-20(17)11-15(19)4/h6,8,11,19-20H,7,9-10,12H2,1-5H3/b13-8+,14-6+,15-11+/t19-,20+/m0/s1 GLMKCGIRLHWKCY-FKHMABJLBT 13-Acetoxy 3β-tigloyl-germacra-1(10)E,4E,7(11)-trien-12,6α-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-(1-Hydroxy-8-methoxy-3-methyl-naphthalen-2-yl)-1,3-dimethyl-1,2,3,4-tetrahydro-isoquinolin-8-ol rel-(1R,3R)-7-(1-hydroxy-8-methoxy-3-methyl-2-naphthyl)-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol 8-isoquinolinol, 1,2,3,4-tetrahydro-7-(1-hydroxy-8-methoxy-3-methyl-2-naphthalenyl)-1,3-dimethyl-, (1R,3R)- InChI=1/C23H25NO3/c1-12-10-15-6-5-7-18(27-4)21(15)23(26)19(12)17-9-8-16-11-13(2)24-14(3)20(16)22(17)25/h5-10,13-14,24-26H,11H2,1-4H3/t13-,14-/m1/s1 BLXBQYFTXJFAFN-ZIAGYGMSBE Dioncophylline E . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Methyl-5-(1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydro-naphthalen-1-yl)-pent-2-enoic acid rel-(2E)-3-methyl-5-[(1R,2R,4aS,8aS)-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl]pent-2-enoic acid 2-pentenoic acid, 3-methyl-5-[(1S,2S,4aR,8aR)-1,2,3,4,4a,7,8,8a-octahydro-1,2,4a,5-tetramethyl-1-naphthalenyl]-, (2E)- InChI=1/C20H32O2/c1-14(13-18(21)22)9-11-19(4)16(3)10-12-20(5)15(2)7-6-8-17(19)20/h7,13,16-17H,6,8-12H2,1-5H3,(H,21,22)/b14-13+/t16-,17+,19-,20-/m0/s1 NLVMTSRTOGOFQD-SMNKCIGXBW (5R*,8S*,9S*,10R*)-Cleroda-3,13E-dien-15-oic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Benzoic acid 4-acetoxy-7-oxo-2,7-dihydro-oxepin-2-ylmethyl ester [4-(acetyloxy)-7-oxo-2,7-dihydrooxepin-2-yl]methyl benzoate 2(7H)-oxepinone, 5-(acetyloxy)-7-[(benzoyloxy)methyl]- InChI=1/C16H14O6/c1-11(17)21-13-7-8-15(18)22-14(9-13)10-20-16(19)12-5-3-2-4-6-12/h2-9,14H,10H2,1H3 YQQVJWLMJNRFKQ-UHFFFAOYAW 5-acetoxy-7-benzoyloxymethyl-7H-oxepin-2-one Klaivanolide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(3-Hydroxy-3-isopropenyl-17-isopropyl-5,8,9,13-tetramethyl-hexadecahydro-cyclopenta[a]phenanthren-4-yl)-propionic acid 3-[(3alpha,4alpha,5alpha,10xi,14xi,17beta)-3-hydroxy-3-isopropenyl-17-isopropyl-5,8,9-trimethylestran-4-yl]propanoic acid propanoic acid, 3-[(3alpha,4alpha,5alpha,10xi,14xi,17beta)-3-hydroxy-5,8,9-trimethyl-3-(1-methylethenyl)-17-(1-methylethyl)estran-4-yl]- InChI=1/C30H50O3/c1-19(2)21-9-10-22-26(21,5)15-17-29(8)23-13-14-30(33,20(3)4)24(11-12-25(31)32)27(23,6)16-18-28(22,29)7/h19,21-24,33H,3,9-18H2,1-2,4-8H3,(H,31,32)/t21-,22?,23?,24+,26-,27-,28+,29-,30+/m1/s1 SIOVBNIZEHKFNA-BGLJMXMUBF Dorstenic acid A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,2,6a,6b,9,9,12a-Heptamethyl-10-oxo-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b-hexadecahydro-2H-picene-4a-carboxylic acid (5xi,9xi)-3-oxooleana-11,13(18)-dien-28-oic acid oleana-11,13(18)-dien-28-oic acid, 3-oxo-, (5xi,9xi)- InChI=1/C30H44O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8-9,21-22H,10-18H2,1-7H3,(H,32,33)/t21?,22?,27-,28+,29+,30-/m0/s1 BBWYDBABNGJTKE-ZPNJNIHFBV 3-Oxo-11,13(18)-oleanadien-28-oic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-(3,4,5-Trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-1,4a,5,6,7,7a-hexahydro-cyclopenta[c]pyran-7-carboxylic acid rel-(1R,4aS,7S,7aR)-1-(hexopyranosyloxy)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-7-carboxylic acid cyclopenta[c]pyran-7-carboxylic acid, 1-(hexopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-, (1S,4aR,7R,7aS)- InChI=1/C15H22O9/c16-5-8-10(17)11(18)12(19)15(23-8)24-14-9-6(3-4-22-14)1-2-7(9)13(20)21/h3-4,6-12,14-19H,1-2,5H2,(H,20,21)/t6-,7-,8?,9+,10?,11?,12?,14+,15?/m1/s1 ZUKLFFYDSALIQW-AIBQAMSXBU 8-epi-Grandifloric acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1aR,2R,3R,4aR,6S,7S,7aS,8E,10R,11S,11aS)-2,7-bis(acetyloxy)-10-(benzoyloxy)-1,1,3,6,9-pentamethyl-4-oxo-1,1a,2,3,4,6,7,10,11,11a-decahydro-5H-4a,7a-epoxycyclopenta[a]cyclopropa[f][11]annulen-11-yl re 3-pyridinecarboxylic acid, (1aR,2R,3R,4aR,6S,7S,7aS,8E,10R,11S,11aS)-2,7-bis(acetyloxy)-10-(benzoyloxy)-1,1a,2,3,4,6,7,10,11,11a-decahydro-1,1,3,6,9-pentamethyl-4-oxo-4a,7a-epoxy-5H-cyclopenta[a]cyclo InChI=1/C37H41NO10/c1-19-16-37-32(45-23(5)40)20(2)17-36(37,48-37)31(41)21(3)29(44-22(4)39)26-27(35(26,6)7)30(47-34(43)25-14-11-15-38-18-25)28(19)46-33(42)24-12-9-8-10-13-24/h8-16,18,20-21,26-30,32H,17H2,1-7H3/b19-16+/t20-,21+,26-,27+,28+,29-,30-,32-,36-, YLABXLIBUBLBLD-HSQFRNMGBK 3,12-Diacetyl-7-benzoyl-8-nicotinylingol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Hydroxy-5-isopropyl-3,8-dimethyl-chromen-2-one 6-hydroxy-5-isopropyl-3,8-dimethyl-2H-chromen-2-one 2H-1-benzopyran-2-one, 6-hydroxy-3,8-dimethyl-5-(1-methylethyl)- InChI=1/C14H16O3/c1-7(2)12-10-5-9(4)14(16)17-13(10)8(3)6-11(12)15/h5-7,15H,1-4H3 VAOZKYYIOZFKKZ-UHFFFAOYAG 3,8-Dimethyl-5-isopropyl-6-hydroxycoumarin Mansorin B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(3R,4S,5R,5aS,7R,8R,8aS,9S,10S,12S)-3,5,9,10,12-pentakis(acetyloxy)-5a-hydroxy-2,2,4,7-tetramethyl-1-oxo-2,3,4,5,5a,6,7,8,8a,9,10,11-dodecahydro-1H-4,10-methanodicyclopenta[a,e][9]annulen-8-yl rel-ben 4,10-methano-1H-dicyclopenta[a,e]cyclononen-1-one, 3,5,9,10,12-pentakis(acetyloxy)-8-(benzoyloxy)-2,3,4,5,5a,6,7,8,8a,9,10,11-dodecahydro-5a-hydroxy-2,2,4,7-tetramethyl-, (3S,4R,5S,5aR,7S,8S,8aR,9R,10 InChI=1/C37H44O14/c1-17-15-36(45)26(27(17)50-31(44)23-13-11-10-12-14-23)30(47-19(3)39)37(51-22(6)42)16-24-25(29(46-18(2)38)34(7,8)28(24)43)35(9,32(36)48-20(4)40)33(37)49-21(5)41/h10-14,17,26-27,29-30,32-33,45H,15-16H2,1-9H3/t17-,26+,27-,29-,30+,32-,33+,3 SWSXELQHTSGROU-XJYVLPCLBP 5α,6,11α,14β,17(R)-pentaacetoxy-3β-benzoyloxy-15β-hydroxyseget-8(12)-en-9-one Segetene A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-But-3-en-1-ynyl-[2,2']bithiophenyl 5-but-3-en-1-yn-1-yl-2,2'-bithiophene 2,2'-bithiophene, 5-(3-buten-1-ynyl)- InChI=1/C12H8S2/c1-2-3-5-10-7-8-12(14-10)11-6-4-9-13-11/h2,4,6-9H,1H2 GWAIEOFEEWQORO-UHFFFAOYAX 5-(3-Buten-1-ynyl)-2,2'-bithiophene BBT . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,4,5-Trihydroxy-benzoic acid 5-acetoxy-2-[5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxy-phenyl)-4H-chromen-3-yloxy]-4-hydroxy-6-methyl-tetrahydro-pyran-3-yl ester 5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)-4H-chromen-3-yl 4-O-acetyl-6-deoxy-2-O-(3,4,5-trihydroxybenzoyl)hexopyranoside 4H-1-benzopyran-4-one, 3-[[4-O-acetyl-6-deoxy-2-O-(3,4,5-trihydroxybenzoyl)hexopyranosyl]oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)- InChI=1/C30H26O17/c1-9-25(44-10(2)31)24(41)28(46-29(42)12-5-17(36)22(39)18(37)6-12)30(43-9)47-27-23(40)20-14(33)7-13(32)8-19(20)45-26(27)11-3-15(34)21(38)16(35)4-11/h3-9,24-25,28,30,32-39,41H,1-2H3 PYGGSPJDJQBCNV-UHFFFAOYAR Myricetin 3-O-(4''-O-acetyl-2''-O-galloyl)-α-L-rhamnopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-[1-(5,7-Dihydroxy-6-methyl-4-oxo-2-phenyl-chroman-8-yl)-3-methyl-butyl]-5-hydroxy-2,2,6,6-tetramethyl-cyclohex-4-ene-1,3-dione 4-[1-(5,7-dihydroxy-6-methyl-4-oxo-2-phenyl-3,4-dihydro-2H-chromen-8-yl)-3-methylbutyl]-5-hydroxy-2,2,6,6-tetramethylcyclohex-4-ene-1,3-dione 4-cyclohexene-1,3-dione, 4-[1-(3,4-dihydro-5,7-dihydroxy-6-methyl-4-oxo-2-phenyl-2H-1-benzopyran-8-yl)-3-methylbutyl]-5-hydroxy-2,2,6,6-tetramethyl- InChI=1/C31H36O7/c1-15(2)13-18(22-27(35)30(4,5)29(37)31(6,7)28(22)36)21-24(33)16(3)25(34)23-19(32)14-20(38-26(21)23)17-11-9-8-10-12-17/h8-12,15,18,20,33-35H,13-14H2,1-7H3 WKCSXMGLYRSJKO-UHFFFAOYAJ 4-[1-(5,7-Dihydroxy-6-methyl-4-oxo-2-phenyl-chroman-8-yl)-3-methyl-butyl]-5-hydroxy-2,2,6,6-tetramethyl-cyclohex-4-ene-1,3-dione . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(2-Acetyl-4,6,7-trihydroxy-1,2,3,4-tetrahydro-isoquinolin-1-ylmethyl)-6-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-5-vinyl-5,6-dihydro-4H-pyran-3-carboxylic acid methyl ester methyl rel-(2R,3S,4R)-4-{[(1S,4S)-2-acetyl-4,6,7-trihydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl}-2-(hexopyranosyloxy)-3-vinyl-3,4-dihydro-2H-pyran-5-carboxylate 2H-pyran-5-carboxylic acid, 4-[[(1R,4R)-2-acetyl-1,2,3,4-tetrahydro-4,6,7-trihydroxy-1-isoquinolinyl]methyl]-3-ethenyl-2-(hexopyranosyloxy)-3,4-dihydro-, methyl ester, (2S,3R,4S)- InChI=1/C27H35NO13/c1-4-12-13(5-17-14-6-18(31)19(32)7-15(14)20(33)8-28(17)11(2)30)16(25(37)38-3)10-39-26(12)41-27-24(36)23(35)22(34)21(9-29)40-27/h4,6-7,10,12-13,17,20-24,26-27,29,31-36H,1,5,8-9H2,2-3H3/t12-,13+,17-,20+,21?,22?,23?,24?,26+,27?/m1/s1 IZNGUQUMRJUVTA-WCXGMUMNBQ (4R)-4-Hydroxyipecoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-[16-(4-Isopropyl-3,7-dimethyl-octahydro-cyclopenta[1,3]cyclopropa[1,2]benzen-3-yloxy)-hexadeca-7,10,13-trienyl]-4-methoxy-5-methylene-5H-furan-2-one rel-3-((7Z,10Z,13Z)-16-{[(3R,3aR,3bR,4S,7R)-4-isopropyl-3,7-dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzen-3-yl]oxy}hexadeca-7,10,13-trien-1-yl)-4-methoxy-5-methylenefuran-2(5H)-one 2(5H)-furanone, 4-methoxy-5-methylene-3-[(7Z,10Z,13Z)-16-[[(3R,3aR,3bR,4S,7R)-octahydro-3,7-dimethyl-4-(1-methylethyl)-1H-cyclopenta[1,3]cyclopropa[1,2]benzen-3-yl]oxy]-7,10,13-hexadecatrienyl]- InChI=1/C37H56O4/c1-27(2)30-23-22-28(3)37-25-24-36(5,34(37)32(30)37)40-26-20-18-16-14-12-10-8-7-9-11-13-15-17-19-21-31-33(39-6)29(4)41-35(31)38/h7,9-10,12,16,18,27-28,30,32,34H,4,8,11,13-15,17,19-26H2,1-3,5-6H3/b9-7-,12-10-,18-16-/t28-,30+,32-,34+,36-,37 QHKSMEVDOFESGZ-LECFAHMHBT Artapetalin C . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 7,8-dihydroxy-1,1,4a-trimethyl-6-methylene-5-(2-oxo-2H-chromen-7-yloxymethyl)-decahydro-naphthalen-2-yl ester (2R,4aR,5S,7R,8R,8aR)-7,8-dihydroxy-1,1,4a-trimethyl-6-methylene-5-{[(2-oxo-2H-chromen-7-yl)oxy]methyl}decahydronaphthalen-2-yl rel-acetate 2H-1-benzopyran-2-one, 7-[[(1R,3S,4S,4aS,6S,8aS)-6-(acetyloxy)decahydro-3,4-dihydroxy-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]methoxy]- InChI=1/C26H32O7/c1-14-18(13-31-17-8-6-16-7-9-21(28)33-19(16)12-17)26(5)11-10-20(32-15(2)27)25(3,4)24(26)23(30)22(14)29/h6-9,12,18,20,22-24,29-30H,1,10-11,13H2,2-5H3/t18-,20-,22-,23+,24+,26-/m0/s1 CKPWNMFJQJVNER-DVITTYBWBD Assafoetidnol B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1R,4S,8beta,9beta,24S)-25-{[2-O-(6-deoxyhexopyranosyl)hexopyranosyl]oxy}-24-hydroxy-9,10,14-trimethyl-11-oxo-4,9-cyclo-9,10-secocholest-5-en-1-yl rel-hexopyranoside 4,9-cyclo-9,10-secocholest-5-en-11-one, 25-[[2-O-(6-deoxyhexopyranosyl)hexopyranosyl]oxy]-1-(hexopyranosyloxy)-24-hydroxy-9,10,14-trimethyl-, (1S,4R,8beta,9beta,24R)- InChI=1/C48H80O18/c1-21(10-14-29(51)45(5,6)66-43-40(37(58)34(55)27(20-50)63-43)65-41-38(59)35(56)32(53)22(2)61-41)23-16-17-46(7)28-13-11-24-25(48(28,9)30(52)18-47(23,46)8)12-15-31(44(24,3)4)64-42-39(60)36(57)33(54)26(19-49)62-42/h11,21-23,25-29,31-43,49- OSJOLYOKIKNBHA-GHOWRVDFBS Bryodulcosigenin 3-O-β-glucopyranosyl-26-O-α-rhamnopyranosyl-(1→2)-O-β-glucopyranoside Khekadaengoside N . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-(4-Benzo[1,3]dioxol-5-yl-tetrahydro-furo[3,4-c]furan-1-yl)-4-methoxy-benzo[1,3]dioxole rel-6-[(1R,3aS,4S,6aS)-4-(1,3-benzodioxol-5-yl)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-4-methoxy-1,3-benzodioxole 1,3-benzodioxole, 6-[(1S,3aR,4R,6aR)-4-(1,3-benzodioxol-5-yl)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-4-methoxy- InChI=1/C21H20O7/c1-22-17-5-12(6-18-21(17)28-10-27-18)20-14-8-23-19(13(14)7-24-20)11-2-3-15-16(4-11)26-9-25-15/h2-6,13-14,19-20H,7-10H2,1H3/t13-,14-,19-,20+/m0/s1 FHVJDYZMZCJFRZ-WZBLMQSHBR (+)-5'-Demethoxyepiexcelsin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
[3-(4-Methoxy-4-methyl-pent-2-enyl)-3,3a,4,4-tetramethyl-2,3,3a,4,5,6-hexahydro-1H-inden-2-yl]-methanol rel-{(2R,3S,3aR)-3-[(2E)-4-methoxy-4-methylpent-2-en-1-yl]-3,3a,4,4-tetramethyl-2,3,3a,4,5,6-hexahydro-1H-inden-2-yl}methanol 1H-indene-2-methanol, 2,3,5,6,7,7a-hexahydro-1-[(2E)-4-methoxy-4-methyl-2-pentenyl]-1,7,7,7a-tetramethyl-, (1R,2S,7aS)- InChI=1/C21H36O2/c1-18(2)11-8-10-16-14-17(15-22)20(5,21(16,18)6)13-9-12-19(3,4)23-7/h9-10,12,17,22H,8,11,13-15H2,1-7H3/b12-9+/t17-,20-,21-/m1/s1 DPANXCSSRQMXFP-YRNMDIJABA 14-Methoxy-13,14-dihydroanisotom-12E-ene-1-ol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4,7-Bis-hydroxymethyl-1-methoxy-4,4a,5,7a-tetrahydro-1H-cyclopenta[c]pyran-3-one rel-(1R,4S)-4,7-bis(hydroxymethyl)-1-methoxy-4,4a,5,7a-tetrahydrocyclopenta[c]pyran-3(1H)-one cyclopenta[c]pyran-3(1H)-one, 4,4a,5,7a-tetrahydro-4,7-bis(hydroxymethyl)-1-methoxy-, (1R,4S)- InChI=1/C11H16O5/c1-15-11-9-6(4-12)2-3-7(9)8(5-13)10(14)16-11/h2,7-9,11-13H,3-5H2,1H3/t7?,8-,9?,11-/m1/s1 DIZSYMXWQCKVJY-FOLWWEGKBF (1R,4S,4aS,7aS)-4,7-dihydroxymethyl-1-methoxyl-1,4,4a,7a-tetrahydrocyclopenta-6-ene[e]pyran-3-one 1β-Methoxyl-gardendiol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,4,5-Trihydroxy-benzoic acid 2-[2-(3,4-dihydroxy-phenyl)-5,7-dihydroxy-4-oxo-4H-chromen-8-yl]-4,5-dihydroxy-6-hydroxymethyl-tetrahydro-pyran-3-yl ester 1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-8-yl]-2-O-(3,4,5-trihydroxybenzoyl)hexitol hexitol, 1,5-anhydro-1-C-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-8-yl]-, 2-(3,4,5-trihydroxybenzoate) InChI=1/C28H24O15/c29-8-19-23(38)24(39)27(43-28(40)10-4-16(35)22(37)17(36)5-10)26(42-19)21-14(33)6-13(32)20-15(34)7-18(41-25(20)21)9-1-2-11(30)12(31)3-9/h1-7,19,23-24,26-27,29-33,35-39H,8H2 KVXWWRLZEGVWRD-UHFFFAOYAT 2''-O-Galloylorientin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-[2-(3,4-Dimethoxy-phenyl)-vinyl]-4-methoxy-5,6-dihydro-pyran-2-one 6-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one 2H-pyran-2-one, 6-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5,6-dihydro-4-methoxy-, (6R)- InChI=1/C16H18O5/c1-18-13-9-12(21-16(17)10-13)6-4-11-5-7-14(19-2)15(8-11)20-3/h4-8,10,12H,9H2,1-3H3/b6-4+/t12-/m0/s1 FISBBPCLKKQWQA-FUEXJSSKBG 11-Methoxy-5,6-dihydroyangonin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Methyl-butyric acid 1,1,7,7a-tetramethyl-2-oxo-1a,2,4,5,6,7,7a,7b-octahydro-1H-cyclopropa[a]naphthalen-4-yl ester (1beta)-8-oxoaristol-9-en-1-yl 3-methylbutanoate butanoic acid, 3-methyl-, (1aR,4R,7R,7aR,7bS)-1a,2,4,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl-2-oxo-1H-cyclopropa[a]naphthalen-4-yl ester InChI=1/C20H30O3/c1-11(2)9-16(22)23-15-8-7-12(3)20(6)13(15)10-14(21)17-18(20)19(17,4)5/h10-12,15,17-18H,7-9H2,1-6H3/t12-,15-,17-,18+,20+/m1/s1 PTYVAENMFGJFCK-JZPXUEKVBU (1R,4R,5S,6S,7R)-1-isovaleryloxyaristol-9-en-8-one Kanshone F . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1R,5aR,11S,11aS)-1,10,11-trihydroxy-5a,8,11a,12-tetramethyl-1,2,5,5a,7,7a,10,11,11a,11b-decahydro-2,5-methanonaphtho[1,2-d]oxepine-4,6-dione 2,5-methanonaphth[1,2-d]oxepin-4,6-dione, 1,2,5,5a,7,7a,10,11,11a,11b-decahydro-1,10,11-trihydroxy-5a,8,11a,12-tetramethyl-, (1R,5aR,11S,11aS)- InChI=1/C19H26O6/c1-7-5-10(20)16(23)18(3)9(7)6-11(21)19(4)12-8(2)14(25-17(12)24)13(22)15(18)19/h5,8-10,12-16,20,22-23H,6H2,1-4H3/t8?,9?,10?,12?,13-,14?,15?,16+,18-,19-/m0/s1 PFEUJUXMHXWDQS-CIZFTVFABU Eurycolactone E . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-(3,4-Dihydroxy-4-hydroxymethyl-tetrahydro-furan-2-yloxy)-6-(4-hydroxy-3-methoxy-phenoxy)-2-hydroxymethyl-tetrahydro-pyran-3,4-diol 4-hydroxy-3-methoxyphenyl 2-O-[3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]hexopyranoside hexopyranoside, 4-hydroxy-3-methoxyphenyl 2-O-[tetrahydro-3,4-dihydroxy-4-(hydroxymethyl)-2-furanyl]- InChI=1/C18H26O12/c1-26-10-4-8(2-3-9(10)21)28-16-14(13(23)12(22)11(5-19)29-16)30-17-15(24)18(25,6-20)7-27-17/h2-4,11-17,19-25H,5-7H2,1H3 PGQMRTLJEMEERX-UHFFFAOYAQ 2-Methoxyphenol-4-O-β-apiofuranosyl-(1→2)-β-glucopyranoside Markhamioside F . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Methyl-but-2-enoic acid 6,7,9-trihydroxy-3,6,9-trimethyl-2-oxo-2,3,3a,4,5,6,7,8,9,9b-decahydro-azuleno[4,5-b]furan-4-yl ester (3R,3aS,4R,6R,7R,9S,9bR)-6,7,9-trihydroxy-3,6,9-trimethyl-2-oxo-2,3,3a,4,5,6,7,8,9,9b-decahydroazuleno[4,5-b]furan-4-yl rel-(2Z)-2-methylbut-2-enoate 2-butenoic acid, 2-methyl-, (3aR,4S,6S,7S,9R,9bS)-2,3,3a,4,5,6,7,8,9,9b-decahydro-6,7,9-trihydroxy-3,6,9-trimethyl-2-oxoazuleno[4,5-b]furan-4-yl ester, (2Z)- InChI=1/C20H28O7/c1-6-9(2)17(22)26-12-8-20(5,25)14-11(21)7-19(4,24)15(14)16-13(12)10(3)18(23)27-16/h6,10-13,16,21,24-25H,7-8H2,1-5H3/b9-6-/t10-,11-,12-,13+,16-,19+,20-/m0/s1 XYNUFQXFKOHZQI-IJKLJMITBR 8α-Angeloxy-2α,4α,10β-trihydroxy-6βH,7αH,11βH-1(5)-guaien-12,6α-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
9-[3-(4-Hydroxy-3-methoxy-phenyl)-acryloyloxy]-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-icosahydro-cyclopenta[a]chrysene-3a-carboxylic acid (3beta,5xi,9xi,13xi,18xi)-3-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}lup-20(29)-en-28-oic acid lup-20(29)-en-28-oic acid, 3-[[(2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]oxy]-, (3beta,5xi,9xi,13xi,18xi)- InChI=1/C40H56O6/c1-24(2)26-15-20-40(35(43)44)22-21-38(6)27(34(26)40)11-13-31-37(5)18-17-32(36(3,4)30(37)16-19-39(31,38)7)46-33(42)14-10-25-9-12-28(41)29(23-25)45-8/h9-10,12,14,23,26-27,30-32,34,41H,1,11,13,15-22H2,2-8H3,(H,43,44)/b14-10+/t26-,27?,30?,31 UXUVZTGGSMRNDQ-RRLFJFQUBV 3α-E-ferulyloxy-lup-20(29)-en-28-oic acid Lawsonic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,5-Dimethyl-9-methylene-tricyclo[6.2.2.0^(2,6)]dodecane rel-(1R,3aS,4R,7R,8aR)-1,4-dimethyl-6-methylenedecahydro-4,7-ethanoazulene 4,7-ethanoazulene, decahydro-1,4-dimethyl-6-methylene-, (1R,3aS,4R,7R,8aR)- InChI=1/C15H24/c1-10-4-5-14-13(10)8-12-6-7-15(14,3)9-11(12)2/h10,12-14H,2,4-9H2,1,3H3/t10-,12-,13-,14+,15-/m1/s1 NPHFULIVCUBDDN-DVLUHMITBV (-)-Isorotundene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(6-Hydroxy-1-vinyl-hexyloxy)-6-(3,4,5-trihydroxy-tetrahydro-pyran-2-yloxymethyl)-tetrahydro-pyran-3,4,5-triol (1R)-6-hydroxy-1-vinylhexyl rel-6-O-beta-D-xylopyranosyl-beta-D-glucopyranoside beta-D-glucopyranoside, (1R)-1-ethenyl-6-hydroxyhexyl 6-O-beta-D-xylopyranosyl- InChI=1/C19H34O11/c1-2-10(6-4-3-5-7-20)29-19-17(26)15(24)14(23)12(30-19)9-28-18-16(25)13(22)11(21)8-27-18/h2,10-26H,1,3-9H2/t10-,11+,12+,13-,14+,15-,16+,17+,18-,19+/m0/s1 KTXHXKVYQSVMQS-XXVXCGOIBS (6R)-7-octene-1,6-diol 6-O-β-D-xylopyranosyl-(1→6)-O-β-D-glucopyranoside Ebracteatoside D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-Chloro-4-hydroxy-2-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-4H-benzo[1,4]oxazin-3-one 7-chloro-4-hydroxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl hexopyranoside 2H-1,4-benzoxazin-3(4H)-one, 7-chloro-2-(hexopyranosyloxy)-4-hydroxy-, (2R)- InChI=1/C14H16ClNO9/c15-5-1-2-6-7(3-5)23-14(12(21)16(6)22)25-13-11(20)10(19)9(18)8(4-17)24-13/h1-3,8-11,13-14,17-20,22H,4H2/t8?,9?,10?,11?,13?,14-/m1/s1 XEGGMKDQOCMCAD-NZCJCNCQBP 7-Chloro-(2R)-2-O-β-D-glucopyranosyl-4-hydroxy-2H-1,4-benzoxazin-3(4H)-one 7-Cl-DIBOA-Glc . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(4-Hydroxy-phenyl)-acrylic acid 2-[2-(3,4-dihydroxy-phenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yloxy]-4,5-dihydroxy-6-(3,4,5-trihydroxy-tetrahydro-pyran-2-yloxymethyl)-tetrahydro-pyran-3-yl ester 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 2-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-O-pentopyranosylhexopyranoside 4H-1-benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[[2-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-6-O-pentopyranosylhexopyranosyl]oxy]- InChI=1/C35H34O18/c36-16-5-1-14(2-6-16)3-8-24(42)52-33-29(46)27(44)23(13-49-34-30(47)26(43)21(41)12-48-34)51-35(33)53-32-28(45)25-20(40)10-17(37)11-22(25)50-31(32)15-4-7-18(38)19(39)9-15/h1-11,21,23,26-27,29-30,33-41,43-44,46-47H,12-13H2/b8-3+ ATXVYGWDRPMCPT-FPYGCLRLBN Quercetin 3-O-α-L-arabinopyranosyl-(1→6)-[2''-O-(E)-p-coumaroyl]-β-D-galactopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 3-acetoxy-2-(2,8-dihydroxy-7-methoxy-5,10-dioxo-5,10-dihydro-chromeno[5,4,3-cde]chromen-3-yloxy)-5-hydroxy-6-methyl-tetrahydro-pyran-4-yl ester 2,8-dihydroxy-7-methoxy-5,10-dioxo-5,10-dihydrochromeno[5,4,3-cde]chromen-3-yl 2,3-di-O-acetyl-6-deoxyhexopyranoside [1]benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 3-[(2,3-di-O-acetyl-6-deoxyhexopyranosyl)oxy]-2,8-dihydroxy-7-methoxy- InChI=1/C25H22O14/c1-7-16(29)21(35-8(2)26)22(36-9(3)27)25(34-7)39-18-12(28)5-10-15-14-11(24(32)38-20(15)18)6-13(33-4)17(30)19(14)37-23(10)31/h5-7,16,21-22,25,28-30H,1-4H3 KNGJTKQJDRESAB-UHFFFAOYAW 4'-O-Methylellagic acid 3-(2'',3''-di-O-acetyl)-α-L-rhamnoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(5-Butyl-3-oxo-2,3-dihydro-furan-2-yl)-acetic acid (5-butyl-3-oxo-2,3-dihydrofuran-2-yl)acetic acid 2-furanacetic acid, 5-butyl-2,3-dihydro-3-oxo- InChI=1/C10H14O4/c1-2-3-4-7-5-8(11)9(14-7)6-10(12)13/h5,9H,2-4,6H2,1H3,(H,12,13) SVNKCHWDJBIZMI-UHFFFAOYAC (5-Butyl-3-oxo-2,3-dihydrofuran-2-yl)-acetic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Carboxy-2-(6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalen-1-ylmethoxy)-pentanedioic acid rel-3-carboxy-2,3-dideoxy-4-O-{[(1R,4aS,6R,8aR)-6-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]methyl}-D-threo-pentaric acid L-threo-pentaric acid, 3-carboxy-2,3-dideoxy-4-O-[[(1S,4aR,6S,8aS)-1,4,4a,5,6,7,8,8a-octahydro-6-hydroxy-2,5,5,8a-tetramethyl-1-naphthalenyl]methyl]- InChI=1/C21H32O8/c1-11-5-6-14-20(2,3)15(22)7-8-21(14,4)13(11)10-29-17(19(27)28)12(18(25)26)9-16(23)24/h5,12-15,17,22H,6-10H2,1-4H3,(H,23,24)(H,25,26)(H,27,28)/t12-,13-,14-,15-,17+,21+/m0/s1 RIUQIOHIZIJIQO-OECSREOEBR Isocryptoporic acid I . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1beta,8xi,13alpha,15R)-8,15-epoxypimarane-1,16-diol 2H-3,5a-methanonaphth[2,1-b]oxepin-4-methanol, dodecahydro-11-hydroxy-3,8,8,11a-tetramethyl-, (3R,4R,7aS,11R,11aS,11bR)- InChI=1/C20H34O3/c1-17(2)8-7-15(22)19(4)13(17)6-10-20-12-18(3,9-5-14(19)20)16(11-21)23-20/h13-16,21-22H,5-12H2,1-4H3/t13-,14+,15+,16-,18+,19-,20?/m0/s1 PWCNHZBWVVQRMD-HOMCEZQUBP 8,15(R)-Epoxypimarane-1β,16-diol Ceriopsin D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,7-Dihydroxy-3-[2-hydroxy-4-methoxy-5-(3-methyl-but-2-enyl)-phenyl]-chroman-4-one 5,7-dihydroxy-3-[2-hydroxy-4-methoxy-5-(3-methylbut-2-en-1-yl)phenyl]-2,3-dihydro-4H-chromen-4-one 4H-1-benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-3-[2-hydroxy-4-methoxy-5-(3-methyl-2-butenyl)phenyl]- InChI=1/C21H22O6/c1-11(2)4-5-12-6-14(16(23)9-18(12)26-3)15-10-27-19-8-13(22)7-17(24)20(19)21(15)25/h4,6-9,15,22-24H,5,10H2,1-3H3 KQGTWGSNAAKPFF-UHFFFAOYAE 5,7,2'-Trihydroxy-4'-methoxy-5'-(3''-methylbut-2''-enyl)isoflavanone Lysisteisoflavanone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-Hydroxy-7,9,13,17-tetramethyl-14-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-octadeca-2,4,8,10,12,16-hexaenoic acid rel-(2E,4E,7R,8E,10E,12E,14R)-7-hydroxy-14-(alpha-L-mannopyranosyloxy)-7,9,13,17-tetramethyloctadeca-2,4,8,10,12,16-hexaenoic acid 2,4,8,10,12,16-octadecahexaenoic acid, 7-hydroxy-14-(alpha-D-mannopyranosyloxy)-7,9,13,17-tetramethyl-, (2E,4E,7S,8E,10E,12E,14S)- InChI=1/C28H42O9/c1-18(2)13-14-21(36-27-26(34)25(33)24(32)22(17-29)37-27)20(4)11-9-10-19(3)16-28(5,35)15-8-6-7-12-23(30)31/h6-13,16,21-22,24-27,29,32-35H,14-15,17H2,1-5H3,(H,30,31)/b8-6+,10-9+,12-7+,19-16+,20-11+/t21-,22+,24+,25-,26-,27-,28-/m0/s1 HTGFZKQPJXUSTN-QFVPHOAWBR 14-O-α-D-Mannopyranosyl-(2E,4E,7R,8E,10E,12E,14S)-7,9,13,17-tetramethyl-7,14-dihydroxy-2,4,8,10,12,16-octadecahexaenoic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
10-Isopropyl-1,1,4a,6a,7,12a-hexamethyl-2,3,4,4a,5,6,6a,6b,7,8,9,10,11a,12,12a,13,14,14a-octadecahydro-1H-11-oxa-azuleno[2,1-a]phenanthren-2-ol (3alpha,5xi,16beta,17alpha,24R)-16,24-epoxylanost-8-en-3-ol lanost-8-en-3-ol, 16,24-epoxy-, (3alpha,5xi,16beta,17alpha,24R)- InChI=1/C30H50O2/c1-18(2)22-11-9-19(3)26-23(32-22)17-30(8)21-10-12-24-27(4,5)25(31)14-15-28(24,6)20(21)13-16-29(26,30)7/h18-19,22-26,31H,9-17H2,1-8H3/t19-,22-,23+,24?,25-,26+,28-,29-,30+/m1/s1 XXKDPHVLYCHICP-PYWNBZIDBQ 16,24-Epoxy-3α-hydroxylanost-8-ene Argentatin E . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Benzo[1,3]dioxol-5-yl-5,7-dihydroxy-3,8-dimethoxy-chromen-4-one 2-(1,3-benzodioxol-5-yl)-5,7-dihydroxy-3,8-dimethoxy-4H-chromen-4-one 4H-1-benzopyran-4-one, 2-(1,3-benzodioxol-5-yl)-5,7-dihydroxy-3,8-dimethoxy- InChI=1/C18H14O8/c1-22-16-10(20)6-9(19)13-14(21)18(23-2)15(26-17(13)16)8-3-4-11-12(5-8)25-7-24-11/h3-6,19-20H,7H2,1-2H3 WGJDKSZLQCVWMG-UHFFFAOYAO 3,8-Dimethoxy-5,7-dihydroxy-3',4'-methylenedioxyflavone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-{[3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(6-deoxyhexopyranosyl)-2-O-[3-(3,4-dihydroxyphenyl)acryloyl]hexopyranoside 4H-1-benzopyran-4-one, 7-[[6-O-(6-deoxyhexopyranosyl)-2-O-[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]hexopyranosyl]oxy]-5-hydroxy-2-(4-hydroxyphenyl)-3-[[tetrahydro-3,4-dihydroxy-4-(hydroxymethyl)-2-fu InChI=1/C41H44O22/c1-16-28(48)31(51)33(53)38(58-16)56-13-25-29(49)32(52)36(62-26(47)9-3-17-2-8-21(44)22(45)10-17)39(61-25)59-20-11-23(46)27-24(12-20)60-34(18-4-6-19(43)7-5-18)35(30(27)50)63-40-37(54)41(55,14-42)15-57-40/h2-12,16,25,28-29,31-33,36-40,42-4 AUTADROYLXMWLA-UHFFFAOYAJ Kaempferol 3-O-β-D-apiofuranoside 7-O-α-L-rhamnosyl-(1''''→6''')-O-β-D (2'''-O-E-caffeoylgalactopyranoside) . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
8-Isopropyl-1a,3a,5a-trimethyl-1a,3,3a,4,5,5a,6,7,8b,8c-decahydro-1H-cyclopenta[a]cyclopropa[h]naphthalen-2-one 8-isopropyl-1a,3a,5a-trimethyl-1a,3,3a,4,5,5a,6,7,8b,8c-decahydrocyclopenta[a]cyclopropa[h]naphthalen-2(1H)-one cyclopenta[a]cyclopropa[h]naphthalen-2(1H)-one, 1a,3,3a,4,5,5a,6,7,8b,8c-decahydro-1a,3a,5a-trimethyl-8-(1-methylethyl)- InChI=1/C20H30O/c1-12(2)13-6-7-18(3)8-9-19(4)11-15(21)20(5)10-14(20)17(19)16(13)18/h12,14,17H,6-11H2,1-5H3 JSJSKJKYCVLMHM-UHFFFAOYAR 5-Oxo-neoverrucos-(13)-ene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Hydroxy-6-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-benzoic acid benzyl ester benzyl 2-(beta-glucopyranosyloxy)-6-hydroxybenzoate benzoic acid, 2-(beta-D-glucopyranosyloxy)-6-hydroxy-, phenylmethyl ester InChI=1/C20H22O9/c21-9-14-16(23)17(24)18(25)20(29-14)28-13-8-4-7-12(22)15(13)19(26)27-10-11-5-2-1-3-6-11/h1-8,14,16-18,20-25H,9-10H2/t14-,16-,17+,18-,20-/m1/s1 GTFARABJCNHOHO-UVNCQSPWBF Benzyl 2-O-β-D-glucopyranosyl-2,6-dihydroxybenzoate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-(hexopyranosyloxy)-7-hydroxy-2-(4-hydroxyphenyl)chromenium-3-yl 2-O-{6-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]hexopyranosyl}hexopyranoside hexopyranoside, 5-(hexopyranosyloxy)-7-hydroxy-2-(4-hydroxyphenyl)-1-benzopyrylium-3-yl 2-O-[6-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]hexopyranosyl]- InChI=1/C43H48O23/c1-58-25-10-17(2-8-22(25)48)3-9-30(49)59-16-29-33(52)35(54)38(57)42(65-29)66-40-36(55)32(51)28(15-45)64-43(40)62-26-13-21-23(60-39(26)18-4-6-19(46)7-5-18)11-20(47)12-24(21)61-41-37(56)34(53)31(50)27(14-44)63-41/h2-13,27-29,31-38,40-45,5 UGTGIJBSJYTLCT-IKLDFBCSAQ Pelargonidin 3-O-[6-O-(E)-feruloyl-2-O-β-D-glucopyranosyl-(1→2)-β-D-glucopyranoside]-5-O-(β-D-glucopyranoside) . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-(3,4-Dihydroxy-phenyl)-3-(4-hydroxy-3,5-dimethoxy-phenyl)-tetrahydro-furo[3,4-c]furan-1-one rel-(3R,6R)-6-(3,4-dihydroxyphenyl)-3-(4-hydroxy-3,5-dimethoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan-1-one 1H,3H-furo[3,4-c]furan-1-one, 6-(3,4-dihydroxyphenyl)tetrahydro-3-(4-hydroxy-3,5-dimethoxyphenyl)-, (3S,6S)- InChI=1/C20H20O8/c1-25-14-6-10(7-15(26-2)17(14)23)18-11-8-27-19(16(11)20(24)28-18)9-3-4-12(21)13(22)5-9/h3-7,11,16,18-19,21-23H,8H2,1-2H3/t11?,16?,18-,19-/m1/s1 HTEHANGVKGKXLH-CGCNGDSTBR 2α-Guaicyl-4-oxo-6α-catechyl-3,7-dioxabicyclo[3.3.0]octane . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,8-Dihydroxy-2-(1-hydroxy-1-methyl-ethyl)-4a,8-dimethyl-octahydro-naphthalene-1,5-dione rel-(2R,4aR,8S)-2,8-dihydroxy-2-(1-hydroxy-1-methylethyl)-4a,8-dimethyloctahydronaphthalene-1,5-dione 1,5-naphthalenedione, octahydro-2,8-dihydroxy-2-(1-hydroxy-1-methylethyl)-4a,8-dimethyl-, (2R,4aR,8S)- InChI=1/C15H24O5/c1-12(2,18)15(20)8-7-13(3)9(16)5-6-14(4,19)10(13)11(15)17/h10,18-20H,5-8H2,1-4H3/t10?,13-,14-,15-/m0/s1 WTGXBQYPXRTHHF-TZBIUDEABA 4β,7α,11-Trihydroxyeudesmane-1,6-dione . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(1H-Indol-3-ylmethyl)-6-isopropyl-3,6-bis-methylsulfanyl-piperazine-2,5-dione rel-(3R,6R)-3-(1H-indol-3-ylmethyl)-6-isopropyl-3,6-bis(methylthio)piperazine-2,5-dione 2,5-piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(1-methylethyl)-3,6-bis(methylthio)-, (3R,6R)- InChI=1/C18H23N3O2S2/c1-11(2)18(25-4)16(23)20-17(24-3,15(22)21-18)9-12-10-19-14-8-6-5-7-13(12)14/h5-8,10-11,19H,9H2,1-4H3,(H,20,23)(H,21,22)/t17-,18-/m1/s1 JXDWMFMAEDSXNI-QZTJIDSGBR Polanrazine B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-{1,5-Dihydroxy-3-methyl-8-[3,4,5-trihydroxy-6-(3,4,5-trihydroxy-tetrahydro-pyran-2-yloxymethyl)-tetrahydro-pyran-2-yloxy]-naphthalen-2-yl}-ethanone 7-acetyl-4,8-dihydroxy-6-methyl-1-naphthyl 6-O-pentopyranosylhexopyranoside ethanone, 1-[1,5-dihydroxy-3-methyl-8-[(6-O-pentopyranosylhexopyranosyl)oxy]-2-naphthalenyl]- InChI=1/C24H30O13/c1-8-5-10-11(26)3-4-13(16(10)19(30)15(8)9(2)25)36-24-22(33)20(31)18(29)14(37-24)7-35-23-21(32)17(28)12(27)6-34-23/h3-5,12,14,17-18,20-24,26-33H,6-7H2,1-2H3 PXPMKWLZBSCHGL-UHFFFAOYAR 2-Acetyl-1,5-dihydroxy-3-methyl-8-O(β-xylopyranosyl-(1→6)-O-(β-glucopyranosyl))naphthalene 2-Acetyl-1,5-dihydroxy-3-methyl-8-O(xylosyl-(1→6)-glucosyl)naphthalene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Isopropyl-8a-methyl-4-methylene-octahydro-naphthalene-1,4a-diol rel-(1R,4aR,6R,8aS)-6-isopropyl-8a-methyl-4-methyleneoctahydronaphthalene-1,4a(2H)-diol 1,4a(2H)-naphthalenediol, octahydro-8a-methyl-4-methylene-6-(1-methylethyl)-, (1R,4aR,6R,8aS)- InChI=1/C15H26O2/c1-10(2)12-7-8-14(4)13(16)6-5-11(3)15(14,17)9-12/h10,12-13,16-17H,3,5-9H2,1-2,4H3/t12-,13-,14+,15-/m1/s1 CKGNGZNSTIOFOY-APIJFGDWBL 4(15)-Eudesmene-1β,5α-diol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,3,7-Trihydroxy-2,8-dimethoxy-xanthen-9-one 1,3,7-trihydroxy-2,8-dimethoxy-9H-xanthen-9-one 9H-xanthen-9-one, 1,3,7-trihydroxy-2,8-dimethoxy- InChI=1/C15H12O7/c1-20-14-6(16)3-4-8-11(14)12(18)10-9(22-8)5-7(17)15(21-2)13(10)19/h3-5,16-17,19H,1-2H3 KUNUETKBUPYSON-UHFFFAOYAI 1,3,7-Trihydroxy-2,8-dimethoxyxanthone Securixanthone A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-(3-Hydroxy-4,4,10,12,14-pentamethyl-2,3,4,5,6,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methyl-hept-2-enoic acid (2Z,6R)-6-[(3alpha,9xi,12beta)-3-hydroxy-4,4,10,12,14-pentamethylgona-7,13(17)-dien-17-yl]-2-methylhept-2-enoic acid 2-heptenoic acid, 6-[(3alpha,9xi,12beta)-3-hydroxy-4,4,10,12,14-pentamethylgona-7,13(17)-dien-17-yl]-2-methyl-, (2Z,6R)- InChI=1/C30H46O3/c1-18(9-8-10-19(2)27(32)33)21-13-15-30(7)22-11-12-24-28(4,5)25(31)14-16-29(24,6)23(22)17-20(3)26(21)30/h10-11,18,20,23-25,31H,8-9,12-17H2,1-7H3,(H,32,33)/b19-10-/t18-,20-,23?,24?,25-,29-,30+/m1/s1 KNYVORLBUHFUJF-FEFWQJOPBZ 3α-Hydroxy-18(13→12β)abeo lanostan-7(8),13(17),24(Z)-trien-26-oic acid Ananosic acid A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(5R,6S,7R,8R)-8-hydroxy-1,2,3,13-tetramethoxy-6,7-dimethyl-5,6,7,8-tetrahydrobenzo[3',4']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxol-5-yl rel-(2E)-2-methylbut-2-enoate 2-butenoic acid, 2-methyl-, (5R,6S,7R,8R)-5,6,7,8-tetrahydro-8-hydroxy-1,2,3,13-tetramethoxy-6,7-dimethylbenzo[3',4']cycloocta[1',2':4,5]benzo[1,2-d][1,3]dioxol-5-yl ester, (2E)- InChI=1/C28H34O9/c1-9-13(2)28(30)37-23-15(4)14(3)22(29)16-10-19-25(36-12-35-19)27(34-8)20(16)21-17(23)11-18(31-5)24(32-6)26(21)33-7/h9-11,14-15,22-23,29H,12H2,1-8H3/b13-9+/t14-,15+,22-,23-/m1/s1 YREZDJJVCCDBTG-INQFUDPWBP Ananosin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 2-(1-bromo-propyl)-5,7-dichloro-8-pent-2-en-4-ynyl-oxocan-4-yl ester (2R,4S,5S,7S,8S)-2-[(1R)-1-bromopropyl]-5,7-dichloro-8-[(2Z)-pent-2-en-4-yn-1-yl]oxocan-4-yl rel-acetate 4-oxocanol, 2-[(1R)-1-bromopropyl]-5,7-dichloro-8-[(2Z)-2-penten-4-ynyl]-, acetate, (2R,4S,5S,7S,8S)- InChI=1/C17H23BrCl2O3/c1-4-6-7-8-15-13(19)9-14(20)17(22-11(3)21)10-16(23-15)12(18)5-2/h1,6-7,12-17H,5,8-10H2,2-3H3/b7-6-/t12-,13+,14+,15+,16-,17+/m1/s1 CGQNAFNBYGFLTH-MWKIHXOOBQ 13-Epilaurencienyne (3Z) . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 1,1,3a,7-tetramethyl-1a,2,3,3a,4,5,7a,7b-octahydro-1H-cyclopropa[a]naphthalen-2-yl ester (1aR,2S,3aR,7bS)-1,1,3a,7-tetramethyl-1a,2,3,3a,4,5,7a,7b-octahydro-1H-cyclopropa[a]naphthalen-2-yl rel-acetate 1H-cyclopropa[a]naphthalen-2-ol, 1a,2,3,3a,4,5,7a,7b-octahydro-1,1,3a,7-tetramethyl-, acetate, (1aR,2S,3aR,7bS)- InChI=1/C17H26O2/c1-10-7-6-8-17(5)9-12(19-11(2)18)14-15(13(10)17)16(14,3)4/h7,12-15H,6,8-9H2,1-5H3/t12-,13?,14+,15-,17+/m0/s1 VEQCSHPADXTKMC-WKBUFOPNBG (-)-Maali-3-en-8α-ol acetate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6,9-Dimethyl-3-methylene-3,3a,4,5,6,6a,7,8-octahydro-1-oxa-cyclopenta[d]naphthalen-2-one rel-(3aR,6S,6aR,10aR)-6,9-dimethyl-3-methylene-3,3a,4,5,6,6a,7,8-octahydro-2H-naphtho[8a,1-b]furan-2-one 2H-naphtho[8a,1-b]furan-2-one, 3,3a,4,5,6,6a,7,8-octahydro-6,9-dimethyl-3-methylene-, (3aS,6R,6aS,10aS)- InChI=1/C15H20O2/c1-9-4-6-12-10(2)5-7-13-11(3)14(16)17-15(12,13)8-9/h8,10,12-13H,3-7H2,1-2H3/t10-,12+,13+,15-/m1/s1 FRCNDCUEKFCJQI-GVUJHPQVBV Deoxyarteannuin B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(2alpha,5alpha,7beta,9alpha,10beta,12alpha)-2,7,9,10-tetrakis(acetyloxy)-5-{[(3R)-3-(dimethylamino)-3-phenylpropanoyl]oxy}-11-hydroxy-13-oxo-12,17-epoxytax-4(20)-en-19-yl benzoate benzenepropanoic acid, beta-(dimethylamino)-, (1S,3aR,4R,5R,5aR,7S,9S,9aR,10R,11S,11aR)-5,9,10,11-tetrakis(acetyloxy)-9a-[(benzoyloxy)methyl]tetradecahydro-11a-hydroxy-1,3a-dimethyl-6-methylene-13-oxo InChI=1/C46H55NO15/c1-25-34(62-37(53)21-33(47(8)9)30-16-12-10-13-17-30)22-36(58-26(2)48)45(24-56-42(54)31-18-14-11-15-19-31)38(25)39(59-27(3)49)32-20-35(52)44(7)46(55,43(32,6)23-57-44)41(61-29(5)51)40(45)60-28(4)50/h10-19,32-34,36,38-41,55H,1,20-24H2,2-9 OTDMUTOTRRFOKJ-DEDUXKHRBR 5α-O-(3'-Dimethylamino-3'-phenylpropionyl) taxinine M . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(3,4-Dihydroxy-phenyl)-acrylic acid 3,4,5-trihydroxy-6-(8-hydroxy-2-oxo-2H-chromen-7-yloxy)-tetrahydro-pyran-2-ylmethyl ester 8-hydroxy-2-oxo-2H-chromen-7-yl 6-O-[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]hexopyranoside 2H-1-benzopyran-2-one, 7-[[6-O-[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]hexopyranosyl]oxy]-8-hydroxy- InChI=1/C24H22O12/c25-13-5-1-11(9-14(13)26)2-7-17(27)33-10-16-19(29)21(31)22(32)24(35-16)34-15-6-3-12-4-8-18(28)36-23(12)20(15)30/h1-9,16,19,21-22,24-26,29-32H,10H2/b7-2+ NRXBNSBNWUANMF-FARCUNLSBV 7-O-[6'-O-(3'',4''-Dihydroxycinnamoyl)-β-D-glucopyranosyl]-8-hydroxycoumarin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-Hydroxy-3-hydroxymethyl-5,5-dimethyl-4-[3-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-but-1-enyl]-cyclohex-2-enone (1R,2E)-3-[(1R)-1-hydroxy-2-(hydroxymethyl)-6,6-dimethyl-4-oxocyclohex-2-en-1-yl]-1-methylprop-2-en-1-yl rel-hexopyranoside 2-cyclohexen-1-one, 4-[(1E,3S)-3-(hexopyranosyloxy)-1-butenyl]-4-hydroxy-3-(hydroxymethyl)-5,5-dimethyl-, (4S)- InChI=1/C19H30O9/c1-10(27-17-16(25)15(24)14(23)13(9-21)28-17)4-5-19(26)11(8-20)6-12(22)7-18(19,2)3/h4-6,10,13-17,20-21,23-26H,7-9H2,1-3H3/b5-4+/t10-,13?,14?,15?,16?,17?,19+/m0/s1 STLXSEIODIBOIC-VYYQLSEVBK (6S,9S)-6-Hydroxyinamoside ((-)-(6S,9S)-9-O-β-D-glucopyranosyloxy-6,13-dihydroxy-3-oxo-α-ionol Spionoside A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-isopropyl-3-methyl-8-methylene-4a,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one 5-isopropyl-3-methyl-8-methylene-4a,5,6,7,8,8a-hexahydronaphthalen-2(1H)-one 2(1H)-naphthalenone, 4a,5,6,7,8,8a-hexahydro-3-methyl-8-methylene-5-(1-methylethyl)- InChI=1/C15H22O/c1-9(2)12-6-5-10(3)13-8-15(16)11(4)7-14(12)13/h7,9,12-14H,3,5-6,8H2,1-2,4H3 QUTSKAAVYUOEQA-UHFFFAOYAT 5-isopropyl-3-methyl-8-methylene-4a,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one Cadina-4,10(15)-dien-3-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-[1-(5-Hydroxy-3-hydroxymethyl-pent-3-enyl)-1,2,5-trimethyl-1,3,4,7,8,8a-hexahydro-2H-naphthalen-4a-ylmethoxy]-6-hydroxymethyl-tetrahydro-pyran-3,4,5-triol [(1R,2S,4aR)-1-[(3Z)-5-hydroxy-3-(hydroxymethyl)pent-3-en-1-yl]-1,2,5-trimethyl-1,3,4,7,8,8a-hexahydronaphthalen-4a(2H)-yl]methyl rel-hexopyranoside hexopyranoside, [(1S,2R,4aS)-1,3,4,7,8,8a-hexahydro-1-[(3Z)-5-hydroxy-3-(hydroxymethyl)-3-pentenyl]-1,2,5-trimethyl-4a(2H)-naphthalenyl]methyl InChI=1/C26H44O8/c1-16-7-11-26(15-33-24-23(32)22(31)21(30)19(14-29)34-24)17(2)5-4-6-20(26)25(16,3)10-8-18(13-28)9-12-27/h5,9,16,19-24,27-32H,4,6-8,10-15H2,1-3H3/b18-9-/t16-,19?,20?,21?,22?,23?,24?,25+,26-/m1/s1 NRZBODCTCGUFOH-XWMIBLCFBY Cussoside A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
methyl rel-(1a'R,2R,5'R,6a'R)-5'-(hexopyranosyloxy)-4-(4-hydroxy-3-methoxybenzoyl)-5-oxo-1a',5',5a',6a'-tetrahydro-1b'H,5H-spiro[furan-2,6'-oxireno[3,4]cyclopenta[1,2-c]pyran]-2'-carboxylate spiro[furan-2(5H),6'(5'H)-oxireno[3,4]cyclopenta[1,2-c]pyran]-2'-carboxylic acid, 5'-(hexopyranosyloxy)-1'a,1'b,5'a,6'a-tetrahydro-4-(4-hydroxy-3-methoxybenzoyl)-5-oxo-, methyl ester, (1a'S,2S,5'S,6a' InChI=1/C27H28O15/c1-36-13-5-9(3-4-12(13)29)17(30)10-6-27(42-24(10)35)16-15(21-22(27)40-21)11(23(34)37-2)8-38-25(16)41-26-20(33)19(32)18(31)14(7-28)39-26/h3-6,8,14-16,18-22,25-26,28-29,31-33H,7H2,1-2H3/t14?,15?,16?,18?,19?,20?,21-,22-,25-,26?,27-/m0/s1 KAKHKTCZSFQJKF-HAMXGZJKBG Yopaaoside A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(2R,3R,3'S,4S,4'R,4aS,10bS)-8-methoxy-3,4',4a,5',5',7-hexamethyl-4,4',4a,5,5',6-hexahydro-3H,3'H-spiro[4,10b-ethanobenzo[h]chromene-2,2'-furan]-3'-ol 1,2,3-propanetriol, 2-[(2R,4aS,7S,8aS)-7-(acetyloxy)decahydro-8a-hydroxy-4a-methyl-8-methylene-2-naphthalenyl]- InChI=1/C25H36O4/c1-14-17-10-12-23(6)18-11-13-24(23,19(17)8-9-20(14)27-7)29-25(15(18)2)21(26)16(3)22(4,5)28-25/h8-9,15-16,18,21,26H,10-13H2,1-7H3/t15-,16-,18+,21+,23+,24-,25-/m0/s1 QEVQGAGSLSJTLO-TVHHQFAEBK (20S,22S,23R,24S)-14β,22:22,25-diepoxy-5-methoxy-des-A-ergosta-5,7,9-trien-23-ol Blazeispirol C . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 7-(1,2-dihydroxy-1-hydroxymethyl-ethyl)-8a-hydroxy-4a-methyl-1-methylene-decahydro-naphthalen-2-yl ester (2R,4aR,7S,8aR)-7-[1,2-dihydroxy-1-(hydroxymethyl)ethyl]-8a-hydroxy-4a-methyl-1-methylenedecahydronaphthalen-2-yl rel-acetate 1,2,3-propanetriol, 2-[(2R,4aS,7S,8aS)-7-(acetyloxy)decahydro-8a-hydroxy-4a-methyl-8-methylene-2-naphthalenyl]- InChI=1/C17H28O6/c1-11-14(23-12(2)20)5-7-15(3)6-4-13(8-17(11,15)22)16(21,9-18)10-19/h13-14,18-19,21-22H,1,4-10H2,2-3H3/t13-,14+,15+,17-/m1/s1 HWCNZSOYAGQUOW-WBTNSWJXBY 3β-Acetoxy,5α,11,12,13-tetrahydroxy-eudesm-4(15)-ene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(4-Hydroxy-benzyl)-4-(4-hydroxy-benzyloxymethyl)-phenol 2-(4-hydroxybenzyl)-4-{[(4-hydroxybenzyl)oxy]methyl}phenol phenol, 4-[[(4-hydroxyphenyl)methoxy]methyl]-2-[(4-hydroxyphenyl)methyl]- InChI=1/C21H20O4/c22-19-6-1-15(2-7-19)11-18-12-17(5-10-21(18)24)14-25-13-16-3-8-20(23)9-4-16/h1-10,12,22-24H,11,13-14H2 QBQNMIPDPJEZHR-UHFFFAOYAC Gastrol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-[(1R,2S,3S,6Z)-2-[(3E,7E)-5-(hexopyranosyloxy)-12-hydroxy-4,8,12-trimethyl-11-oxotrideca-3,7-dien-1-yl]-3-hydroxy-2,3-dimethyl-6-(1-methyl-2-oxoethylidene)cyclohexyl]propyl rel-hexopyranoside propanal, 2-[(2R,3S,4S)-3-[(3E,7E)-5-(hexopyranosyloxy)-12-hydroxy-4,8,12-trimethyl-11-oxo-3,7-tridecadienyl]-2-[3-(hexopyranosyloxy)propyl]-4-hydroxy-3,4-dimethylcyclohexylidene]-, (2Z)- InChI=1/C42H70O16/c1-23(13-15-31(46)40(4,5)53)12-14-28(56-39-37(52)35(50)33(48)30(22-45)58-39)24(2)10-8-17-41(6)27(26(25(3)20-43)16-18-42(41,7)54)11-9-19-55-38-36(51)34(49)32(47)29(21-44)57-38/h10,12,20,27-30,32-39,44-45,47-54H,8-9,11,13-19,21-22H2,1-7H3 MULHNQJKMHOLAZ-SPHPDEOZBM 22-oxo-23-hydroxy-iridal-3,16-di-β-D-glucopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
12-Hydroxy-3,11a-dimethyl-3,3a,4,5,5a,5b,6,7,11a,11b,12,13-dodecahydro-2H-2-aza-pentaleno[1,6a-a]phenanthrene-1,9-dione 12-hydroxy-3,11a-dimethyl-3,3a,4,5,5a,5b,6,7,11a,11b,12,13-dodecahydro-1H-naphtho[2',1':4,5]indeno[1,7a-c]pyrrole-1,9(2H)-dione 1H-naphth[2',1':4,5]indeno[1,7a-c]pyrrole-1,9(2H)-dione, 3,3a,4,5,5a,5b,6,7,11a,11b,12,13-dodecahydro-12-hydroxy-3,11a-dimethyl- InChI=1/C21H27NO3/c1-11-15-5-6-16-14-4-3-12-9-13(23)7-8-20(12,2)18(14)17(24)10-21(15,16)19(25)22-11/h7-9,11,14-18,24H,3-6,10H2,1-2H3,(H,22,25) ZFDFFZSCUSDQEX-UHFFFAOYAB 3,18-Dioxo-11α-hydroxy-cona-1,4-diene Pubamide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl ester 17-oxoestra-1,3,5(10)-trien-3-yl acetate estra-1,3,5(10)-trien-17-one, 3-(acetyloxy)- InChI=1/C20H24O3/c1-12(21)23-14-4-6-15-13(11-14)3-5-17-16(15)9-10-20(2)18(17)7-8-19(20)22/h4,6,11,16-18H,3,5,7-10H2,1-2H3 KDPQTPZDVJHMET-UHFFFAOYAN 3-Acetoxy-17-oxo-estra-1,3,5(10)-triene Puboestrene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1R,3S,17R,18S,19S,20R,21R,22S,23S,24S,25R)-20-[(acetyloxy)methyl]-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0~1,20~.0~3,23~.0~7,12~]pentacosa-7,9,11-trie 9,10-anthracenedione, 3-(hexopyranosyloxy)-1,8-dihydroxy-6-methyl- InChI=1/C36H45NO17/c1-15-16(2)31(44)53-28-25(43)29(51-20(6)41)35(14-47-17(3)38)30(52-21(7)42)26(49-18(4)39)23-27(50-19(5)40)36(35,34(28,9)46)54-33(23,8)13-48-32(45)22-11-10-12-37-24(15)22/h10-12,15-16,23,25-30,43,46H,13-14H2,1-9H3/t15?,16?,23-,25+,26-,27 VWRGSMDCPWKKRO-PZRNIPAKBY 4-Hydroxy-7-epi-chuchuhuanine E-V . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,8-Dihydroxy-3-methyl-6-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-anthraquinone 4,5-dihydroxy-7-methyl-9,10-dioxo-9,10-dihydroanthracen-2-yl hexopyranoside 9,10-anthracenedione, 3-(hexopyranosyloxy)-1,8-dihydroxy-6-methyl- InChI=1/C21H20O10/c1-7-2-9-14(11(23)3-7)18(27)15-10(16(9)25)4-8(5-12(15)24)30-21-20(29)19(28)17(26)13(6-22)31-21/h2-5,13,17,19-24,26,28-29H,6H2,1H3 UBVJENDWBOVRBS-UHFFFAOYAA 3-β-D-glucopyranosyloxy-1,8-dihydroxy-6-methyl-anthraquinone Emodin-6-O-β-D-glucopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-chloro-2-(3,4-dihydroxy-phenyl)-chroman-3,5,7-triol rel-(2R,3S)-6-chloro-2-(3,4-dihydroxyphenyl)chromane-3,5,7-triol 2H-1-benzopyran-3,5,7-triol, 6-chloro-2-(3,4-dihydroxyphenyl)-3,4-dihydro-, (2R,3S)- InChI=1/C15H13ClO6/c16-13-10(19)5-12-7(14(13)21)4-11(20)15(22-12)6-1-2-8(17)9(18)3-6/h1-3,5,11,15,17-21H,4H2/t11-,15+/m0/s1 BHTBHJNGFQRAJI-XHDPSFHLBB (-)-6-chloroepicatechin (2R,3S)-6-chloro-5,7,3',4'-tetrahydroxylflavan-3-ol 6-Chlorocatechin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-methyl-7-[3,4,5-trihydroxy-6-(3,4,5-trihydroxy-tetrahydro-pyran-2-yloxymethyl)-tetrahydro-pyran-2-yloxy]-3H-isobenzofuran-1-one 7-methyl-3-oxo-1,3-dihydro-2-benzofuran-4-yl 6-O-pentopyranosylhexopyranoside 1(3H)-isobenzofuranone, 4-methyl-7-[(6-O-pentopyranosylhexopyranosyl)oxy]- InChI=1/C20H26O12/c1-7-2-3-10(12-8(7)4-28-18(12)27)31-20-17(26)15(24)14(23)11(32-20)6-30-19-16(25)13(22)9(21)5-29-19/h2-3,9,11,13-17,19-26H,4-6H2,1H3 QSTWATBAAMDBSL-UHFFFAOYAT 7-O-[β-glucopyranosyl-(1→6)-β-arabinopyranosyl]-7-hydroxy-4-methyl-1[3H]-isobenzofuranone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(2R,5R,7R,8S,9S)-2-[(7E,9E,13Z)-15-amino-3,5-dihydroxy-1-methoxy-4,6,8,9,13-pentamethyl-15-oxopentadeca-7,9,13-trien-1-yl]-9-methoxy-4,4,8-trimethyl-7-[(2E)-3-(2-methyl-1,3-oxazol-4-yl)prop-2-en-1-yl] 1H-phenalen-1-one, 7,8,9,9a-tetrahydro-9a-hydroxy-6-methyl-9-(1-methylethenyl)-2-(1-methylethyl)-, (9aS)- InChI=1/C40H65N2O12P/c1-23(18-35(41)44)14-12-15-24(2)25(3)19-26(4)36(45)27(5)31(43)20-33(49-10)37-38(54-55(46,47)48)39(8,9)40(53-37)21-34(50-11)28(6)32(52-40)17-13-16-30-22-51-29(7)42-30/h13,15-16,18-19,22,26-28,31-34,36-38,43,45H,12,14,17,20-21H2,1-11H3 NWFMVMFBNZSIHF-ZMTAJWNXBY Swinhoeiamide A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
9a-Hydroxy-9-isopropenyl-2-isopropyl-6-methyl-7,8,9,9a-tetrahydro-phenalen-1-one 9a-hydroxy-9-isopropenyl-2-isopropyl-6-methyl-7,8,9,9a-tetrahydro-1H-phenalen-1-one 1H-phenalen-1-one, 7,8,9,9a-tetrahydro-9a-hydroxy-6-methyl-9-(1-methylethenyl)-2-(1-methylethyl)-, (9aS)- InChI=1/C20H24O2/c1-11(2)16-10-14-7-6-13(5)15-8-9-17(12(3)4)20(22,18(14)15)19(16)21/h6-7,10-11,17,22H,3,8-9H2,1-2,4-5H3/t17?,20-/m0/s1 DLCPEPBEODTUSV-OZBJMMHXBZ Saprirearine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Methyl-2-oxa-9-aza-tricyclo[7.4.3.04,13]hexadec-4(13)-ene-3,8-dione 10-methyl-4,5,6,9,10,11-hexahydro-3H-3,7-propanofuro[3,4-e]azecine-1,8-dione 3H-3,7-propanofuro[3,4-e]azecine-1,8-dione, 4,5,6,9,10,11-hexahydro-10-methyl-, (10R)- InChI=1/C15H21NO3/c1-10-8-12-11-4-2-6-16(14(17)9-10)7-3-5-13(11)19-15(12)18/h10,13H,2-9H2,1H3/t10-,13?/m1/s1 JNUJNSFROLCMND-VUUHIHSGBK Huperzine R . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-(7-Acetoxy-4,9-dimethyl-3,11-dioxo-10-oxa-tricyclo[6.3.2.01,7]tridec-4-en-9-yl)-2-methyl-penta-2,4-dienoic acid rel-(2E,4E)-5-[(3R,4S,4aS,9aR)-4a-(acetyloxy)-3,7-dimethyl-1,8-dioxo-3,4,4a,5,8,9-hexahydro-4,9a-ethanocyclohepta[c]pyran-3-yl]-2-methylpenta-2,4-dienoic acid 2,4-pentadienoic acid, 5-[(3R,4S,4aS,9aR)-4a-(acetyloxy)-3,4,4a,5,8,9-hexahydro-3,7-dimethyl-1,8-dioxo-1H-4,9a-ethanocyclohepta[c]pyran-3-yl]-2-methyl-, (2E,4E)- InChI=1/C22H26O7/c1-13-7-11-22(28-15(3)23)17-8-10-21(22,12-16(13)24)19(27)29-20(17,4)9-5-6-14(2)18(25)26/h5-7,9,17H,8,10-12H2,1-4H3,(H,25,26)/b9-5+,14-6+/t17-,20+,21-,22-/m0/s1 UBHOILGODYTXTA-MRFLEFCVBY Pseudolaric acid F . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Methyl-but-2-enoic acid 11-hydroxy-7-hydroxymethyl-4-(4-hydroxy-4-methyl-pent-2-enyl)-4,11-dimethyl-8-oxo-cycloundeca-2,6,9-trienyl ester (1R,2E,4S,6Z,9E,11R)-11-hydroxy-7-(hydroxymethyl)-4-[(2E)-4-hydroxy-4-methylpent-2-en-1-yl]-4,11-dimethyl-8-oxocycloundeca-2,6,9-trien-1-yl rel-3-methylbut-2-enoate 2-butenoic acid, 3-methyl-, (1R,2E,4S,6Z,9E,11R)-11-hydroxy-7-(hydroxymethyl)-4-[(2E)-4-hydroxy-4-methyl-2-pentenyl]-4,11-dimethyl-8-oxo-2,6,9-cycloundecatrien-1-yl ester InChI=1/C25H36O6/c1-18(2)16-22(28)31-21-10-14-24(5,12-7-11-23(3,4)29)13-8-19(17-26)20(27)9-15-25(21,6)30/h7-11,14-16,21,26,29-30H,12-13,17H2,1-6H3/b11-7+,14-10+,15-9+,19-8-/t21-,24+,25-/m1/s1 BFHUVBRMXMQPJH-KFKQBPMQBX Vibsanol A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1R,2R,3'R,4S,4'R)-3'-bromo-4'-chloro-1,3,3,4'-tetramethyl-7-oxaspiro[bicyclo[2.2.1]heptane-2,1'-cyclohexane] spiro[cyclohexane-1,2'-[7]oxabicyclo[2.2.1]heptane], 3-bromo-4-chloro-1',3',3',4-tetramethyl-, (1R,1'R,3R,4R,4'S)- InChI=1/C15H24BrClO/c1-12(2)11-5-6-14(4,18-11)15(12)8-7-13(3,17)10(16)9-15/h10-11H,5-9H2,1-4H3/t10-,11+,13-,14-,15-/m1/s1 LBKDDPGYNQZCID-OBRUSBNWBY Oxachamigrene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 6-{1-[2-(3-hydroperoxy-2,5,5,8a-tetramethyl-3,4,4a,5,6,7,8,8a-octahydro-naphthalen-1-yl)-ethyl]-1-methyl-allyloxy}-4,5-dihydroxy-tetrahydro-pyran-3-yl ester (1R)-1-{2-[(3R,4aS,8aS)-3-hydroperoxy-2,5,5,8a-tetramethyl-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]ethyl}-1-methylprop-2-en-1-yl rel-4-O-acetyl-6-deoxyhexopyranoside hexopyranoside, (1R)-1-methyl-1-[2-[(3R,4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-3-hydroperoxy-2,5,5,8a-tetramethyl-1-naphthalenyl]ethyl]-2-propenyl 6-deoxy-, 4-acetate InChI=1/C28H46O8/c1-9-27(7,35-25-23(31)22(30)24(17(3)33-25)34-18(4)29)14-11-19-16(2)20(36-32)15-21-26(5,6)12-10-13-28(19,21)8/h9,17,20-25,30-32H,1,10-15H2,2-8H3/t17?,20-,21+,22?,23?,24?,25?,27+,28-/m1/s1 CYFQGASFWKNUEE-LWPYRNSMBH 7α-Hydroperoxylabda-8,14-dien-13(R)-ol-4-O-acetyl-α-L-6-deoxyidopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-(4,5-Dimethoxy-7-methyl-naphthalen-1-yl)-8-methoxy-1,2,3-trimethyl-1,2-dihydro-isoquinolin-6-ol rel-(1R,3R)-5-(4,5-dimethoxy-7-methyl-1-naphthyl)-8-methoxy-1,2,3-trimethyl-1,2,3,4-tetrahydroisoquinolin-6-ol 6-isoquinolinol, 5-(4,5-dimethoxy-7-methyl-1-naphthalenyl)-1,2,3,4-tetrahydro-8-methoxy-1,2,3-trimethyl-, (1R,3R)- InChI=1/C26H31NO4/c1-14-10-18-17(8-9-21(29-5)26(18)22(11-14)30-6)25-19-12-15(2)27(4)16(3)24(19)23(31-7)13-20(25)28/h8-11,13,15-16,28H,12H2,1-7H3/t15-,16-/m1/s1 RNLKCMIGQLHEKX-HZPDHXFCBF Ancistrocongoline C . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-(3-Acetyl-2,6-dihydroxy-4-methoxy-phenyl)-4,5-dihydroxy-2-hydroxymethyl-anthraquinone 1-(3-acetyl-2,6-dihydroxy-4-methoxyphenyl)-4,5-dihydroxy-2-(hydroxymethyl)anthra-9,10-quinone 9,10-anthracenedione, 1-(3-acetyl-2,6-dihydroxy-4-methoxyphenyl)-4,5-dihydroxy-2-(hydroxymethyl)- InChI=1/C24H18O9/c1-9(26)16-15(33-2)7-14(29)19(23(16)31)17-10(8-25)6-13(28)20-21(17)22(30)11-4-3-5-12(27)18(11)24(20)32/h3-7,25,27-29,31H,8H2,1-2H3 XBZFXAYXSQAPPD-UHFFFAOYAA Gaboroquinone B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 2-[2-(3,4-dihydroxy-phenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yloxy]-4,5-dihydroxy-6-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxymethyl)-tetrahydro-pyran-3-yl ester 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 2-O-acetyl-6-O-(6-deoxyhexopyranosyl)hexopyranoside 4H-1-benzopyran-4-one, 3-[[2-O-acetyl-6-O-(6-deoxyhexopyranosyl)hexopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy- InChI=1/C29H32O17/c1-9-19(35)22(38)24(40)28(42-9)41-8-17-20(36)23(39)27(43-10(2)30)29(45-17)46-26-21(37)18-15(34)6-12(31)7-16(18)44-25(26)11-3-4-13(32)14(33)5-11/h3-7,9,17,19-20,22-24,27-29,31-36,38-40H,8H2,1-2H3 OTLZRRUHHNDQIU-UHFFFAOYAQ 2''-O-Acetylrutin Quercetin 3-O-α-L-rhamnopyranosyl(1→6)-2''-O-acetyl-β-D-glucopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,5-Dihydroxy-3H-2,6-dioxa-benzo[def]chrysen-1-one 3,5-dihydroxy-1H,3H-isochromeno[6,5,4-mna]xanthen-1-one 1H,3H-2-benzopyrano[6,5,4-mna]xanthen-1-one, 3,5-dihydroxy- InChI=1/C18H10O5/c19-12-7-11-14-10(17(20)23-18(11)21)6-5-9-8-3-1-2-4-13(8)22-16(12)15(9)14/h1-7,18-19,21H YKOZPDXFYYNZLM-UHFFFAOYAJ 3,5-Dihydroxy-3H-2,6-dioxa-benzo[def]chrysen-1-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(3-hydroxymethyl-4-methyl-1,3,4,7,12,12b-hexahydro-2H,6H-2,6-methano-indolo[2,3-a]quinolizin-13-yl)-methanol rel-[(8R,9S,10S,11S,11aR)-8-methyl-5,6,8,9,10,11,11a,12-octahydro-6,10-methanoindolo[3,2-b]quinolizine-9,11-diyl]dimethanol 1(2H)-naphthalenone, 5-(acetyloxy)octahydro-4-hydroxy-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-, (4R,5R,6R,8aR)- InChI=1/C19H24N2O2/c1-10-14(8-22)12-6-18-19-13(7-17(21(10)18)15(12)9-23)11-4-2-3-5-16(11)20-19/h2-5,10,12,14-15,17-18,20,22-23H,6-9H2,1H3/t10-,12+,14-,15+,17-,18?/m0/s1 PBLXNPSLWYWTKM-OQBZFNBMBN 19(S),20(R)-Dihydroperaksine 21-methyl-19,20-dihydro-18-nor-sarpagane-17,19-diol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 8-hydroxy-2-(1-hydroxy-1-methyl-ethyl)-4a,8-dimethyl-5-oxo-decahydro-naphthalen-1-yl ester (1R,2R,4aR,8R)-8-hydroxy-2-(1-hydroxy-1-methylethyl)-4a,8-dimethyl-5-oxodecahydronaphthalen-1-yl rel-acetate 1(2H)-naphthalenone, 5-(acetyloxy)octahydro-4-hydroxy-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-, (4R,5R,6R,8aR)- InChI=1/C17H28O5/c1-10(18)22-13-11(15(2,3)20)6-8-16(4)12(19)7-9-17(5,21)14(13)16/h11,13-14,20-21H,6-9H2,1-5H3/t11-,13-,14?,16+,17-/m1/s1 DZDNPOJNGAMWJD-BYSDRMFGBL 6β-Acetoxy-4α,11-dihydroxyeudesman-1-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-[1-(2,3-Dihydroxy-1-hydroxymethyl-propoxy)-2-hydroxy-propoxy]-3-{5-[3-(2,4-dihydroxy-phenyl)-3-oxo-propenyl]-2-hydroxy-phenyl}-5-hydroxy-2-(4-hydroxy-phenyl)-chroman-4-one (2R,3S)-3-{5-[(1E)-3-(2,4-dihydroxyphenyl)-3-oxoprop-1-en-1-yl]-2-hydroxyphenyl}-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl rel-hexopyranoside 4H-1-benzopyran-4-one, 3-[5-[(1E)-3-(2,4-dihydroxyphenyl)-3-oxo-1-propenyl]-2-hydroxyphenyl]-7-(hexopyranosyloxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (2S,3R)- InChI=1/C36H32O14/c37-15-28-31(44)33(46)34(47)36(50-28)48-20-13-26(43)30-27(14-20)49-35(17-3-5-18(38)6-4-17)29(32(30)45)22-11-16(2-10-24(22)41)1-9-23(40)21-8-7-19(39)12-25(21)42/h1-14,28-29,31,33-39,41-44,46-47H,15H2/b9-1+/t28?,29-,31?,33?,34?,35+,36?/m0 HQSOJLCLJXXUNB-SPGLSUKZBK 6’’’-Hydroxylophirone B 4’’’-O-β-glucoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-C-(6-sec-butyl-7-{[2,6-dideoxy-3-O-(2,6-dideoxyhexopyranosyl)hexopyranosyl]oxy}-3-{[2,6-dideoxyhexopyranosyl-(1->3)-2,6-dideoxyhexopyranosyl-(1->3)-4-O-acetyl-2,6-dideoxyhexopyranosyl-(1->3)-2,6-did 2-pentulose, 5-deoxy-1-C-[7-[[2,6-dideoxy-3-O-(2,6-dideoxyhexopyranosyl)hexopyranosyl]oxy]-3-[[O--2,6-dideoxyhexopyranosyl-(1->3)-O--2,6-dideoxyhexopyranosyl-(1->3)-O--4-O-acetyl-2,6-dideoxyhexopyrano InChI=1/C62H92O28/c1-12-22(2)47-36(85-43-18-37(53(70)26(6)80-43)86-41-16-34(65)51(68)24(4)78-41)15-32-13-31-14-33(61(77-11)59(76)50(67)23(3)63)62(58(75)49(31)57(74)48(32)56(47)73)90-46-20-39(55(72)28(8)82-46)88-45-21-40(60(29(9)83-45)84-30(10)64)89-44-19 GKQPKEYSNFSHDQ-UHFFFAOYAA Durhamycin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(2alpha,3alpha,5xi,9xi,11alpha,13R,14S,20xi)-3,11,13-tris(acetyloxy)-14-hydroxyhetisan-2-yl rel-2-methylpropanoate propanoic acid, 2-methyl-, (2alpha,3alpha,5xi,9xi,11alpha,13R,14S,20xi)-3,11,13-tris(acetyloxy)-14-hydroxyhetisan-2-yl ester InChI=1/C30H39NO9/c1-12(2)25(35)40-18-10-29-21-17-9-28-8-13(3)19(20(22(28)29)37-14(4)32)24(39-16(6)34)30(28,36)26(29)31(17)11-27(21,7)23(18)38-15(5)33/h12,17-24,26,36H,3,8-11H2,1-2,4-7H3/t17?,18-,19?,20-,21?,22?,23-,24-,26?,27+,28?,29?,30-/m1/s1 LWXKIHSFLLGYQM-XALFCPAIBY Glandulosine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
17-(4-Ethyl-1,5-dimethyl-hexyl)-10,13-dimethyl-1,2,3,4,6,7,9,10,11,12,13,15,16,17-tetradecahydro-20-oxa-cyclopropa[5,6]cyclopenta[a]phenanthrene-3,7-diol (3beta,5alpha,6alpha,7alpha)-5,6-epoxystigmast-8(14)-ene-3,7-diol stigmast-8(14)-ene-3,7-diol, 5,6-epoxy-, (3beta,5alpha,6alpha,7alpha)- InChI=1/C29H48O3/c1-7-19(17(2)3)9-8-18(4)21-10-11-22-24-23(13-14-27(21,22)5)28(6)15-12-20(30)16-29(28)26(32-29)25(24)31/h17-21,23,25-26,30-31H,7-16H2,1-6H3/t18-,19-,20+,21-,23+,25+,26+,27-,28-,29+/m1/s1 LDTVSAVVGTWARS-JTJZISEOBQ 5α,6α-Epoxy-24R*-ethylcholest-8(14)-en-3β,7α-diol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-N-{(1E,3R,4R,5S,6R,9S,10S)-4,6-dihydroxy-11-[(10S,11R,13E,16S,20S,21R,22S,24E)-16-hydroxy-10,22-dimethoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo[24.2.1.1~2,5~.1~6, formamide, [(1E,3R,4R,5S,6R,9S,10S)-4,6-dihydroxy-11-[(10S,11R,13E,16S,20S,21R,22S,24E)-16-hydroxy-10,22-dimethoxy-11,21-dimethyl-12,18-dioxo-3,7,19,27-tetraoxa-29,30,31-triazatetracyclo[24.2.1.1~2,5~ InChI=1/C45H64N4O13/c1-26(16-17-36(53)28(3)42(55)27(2)18-19-49(6)25-50)38(57-8)21-39-30(5)37(56-7)14-11-15-40-46-33(23-59-40)44-48-34(24-61-44)45-47-32(22-60-45)43(58-9)29(4)35(52)13-10-12-31(51)20-41(54)62-39/h10-11,13,15,18-19,22-31,36-39,42-43,51,53,5 LDFWGSQPHWVAFZ-HEZJTTOABV 30,32-Dihydroxymycalolide A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1alpha,4beta,6alpha,7beta,11beta,14alpha,16beta,17R)-20-ethyl-1,6,7-trihydroxy-4-(hydroxymethyl)-8,16-dimethoxyaconitan-14-yl acetate aconitane-1,6,7,14-tetrol, 20-ethyl-4-(hydroxymethyl)-8,16-dimethoxy-, 14-acetate, (1alpha,4beta,6alpha,7beta,11beta,14alpha,16beta,17R)- InChI=1/C25H39NO8/c1-5-26-10-22(11-27)7-6-16(29)24-14-8-13-15(32-3)9-23(33-4,17(14)18(13)34-12(2)28)25(31,21(24)26)20(30)19(22)24/h13-21,27,29-31H,5-11H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20-,21+,22?,23-,24-,25+/m1/s1 OSSCNSALANKATQ-WSYHKBQPBV 18-Demethylpubescenine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-(2-Hydroxy-phenoxymethyl)-furan-2-carbaldehyde 5-[(2-hydroxyphenoxy)methyl]-2-furaldehyde 2-furancarboxaldehyde, 5-[(2-hydroxyphenoxy)methyl]- InChI=1/C12H10O4/c13-7-9-5-6-10(16-9)8-15-12-4-2-1-3-11(12)14/h1-7,14H,8H2 YGLWXHTXSWRORB-UHFFFAOYAJ 5-(2-Hydroxyphenoxymethyl)furfural . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(6-Hydroxy-9H-β-carbolin-1-yl)-(5-hydroxy-1H-indol-3-yl)-methanone (6-hydroxy-9H-beta-carbolin-1-yl)(5-hydroxy-1H-indol-3-yl)methanone methanone, (5-hydroxy-1H-indol-3-yl)(6-hydroxy-9H-pyrido[3,4-b]indol-1-yl)- InChI=1/C20H13N3O3/c24-10-1-3-16-14(8-10)15(9-22-16)20(26)19-18-12(5-6-21-19)13-7-11(25)2-4-17(13)23-18/h1-9,22-25H OATSYJQLKPRTBO-UHFFFAOYAO Hyrtiosulawesine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 17-furan-3-yl-17-hydroxy-4,4,8,10,13-pentamethyl-3,16-dioxo-2,3,4,5,6,7,8,9,10,11,12,13,16,17-tetradecahydro-1H-20-oxa-cyclopropa[1,2]cyclopenta[a]phenanthren-7-yl ester (1alpha,2alpha,7alpha,9xi,13alpha,17beta)-17-(3-furyl)-17-hydroxy-4,4,8-trimethyl-3,16-dioxo-1,2-epoxyandrost-14-en-7-yl acetate androst-14-ene-3,16-dione, 7-(acetyloxy)-1,2-epoxy-17-(3-furanyl)-17-hydroxy-4,4,8-trimethyl-, (1alpha,2alpha,7alpha,9xi,13alpha,17beta)- InChI=1/C28H34O7/c1-14(29)34-20-12-17-24(2,3)22(31)21-23(35-21)27(17,6)16-7-9-25(4)18(26(16,20)5)11-19(30)28(25,32)15-8-10-33-13-15/h8,10-11,13,16-17,20-21,23,32H,7,9,12H2,1-6H3/t16?,17?,20-,21+,23+,25-,26-,27-,28+/m1/s1 HEXOJOUVBWMVKD-SBVUCVBDBE 1α,2α-Epoxy-17β-hydroxyazadiradione . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(2R,2'R,3R,3'S,4a'S,5'R,6'S,8a'R)-5-(3-furyl)-5',6'-dihydroxy-2-methoxy-2',4a',5'-trimethyldecahydro-2'H-spiro[furan-3,1'-naphthalen]-3'-yl rel-acetate spiro[furan-3(2H),1'(2'H)-naphthalene]-3',5',6'-triol, 5-(3-furanyl)decahydro-2-methoxy-2',4'a,5'-trimethyl-, 3'-acetate, (2S,2'S,3S,3'R,4a'R,5'S,6'R,8a'S)- InChI=1/C23H34O7/c1-13-16(29-14(2)24)10-21(3)18(6-7-19(25)22(21,4)26)23(13)11-17(30-20(23)27-5)15-8-9-28-12-15/h8-9,12-13,16-20,25-26H,6-7,10-11H2,1-5H3/t13-,16-,17?,18+,19-,20+,21-,22-,23-/m1/s1 QKNYLJSOBMZFPQ-HSYHHRFJBP Cascarillin E rel-(3R,4S,5R,7R,8S,9R,10S,12R,20S)-7-acetoxy-15,16,12,20-diepoxy-3,4-dihydroxy-20-methoxyneocleroda-13(16),14-diene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Acetyl-6b-hydroxymethyl-10,10,12a,12c-tetramethyl-1,3a,5a,6,6a,6b,7,8,9,10,10a,11,12,12a,12b,12c-hexadecahydro-5-oxa-cyclopenta[hi]chrysen-4-one rel-(3aR,5aR,6aS,6bR,10aS,12aR,12bS,12cS)-3-acetyl-6b-(hydroxymethyl)-10,10,12a,12c-tetramethyl-1,3a,5a,6,6a,6b,7,8,9,10,10a,11,12,12a,12b,12c-hexadecahydro-4H-chryseno[12,1-bc]furan-4-one (non-prefer 4H-chryseno[12,1-bc]furan-4-one, 3-acetyl-1,3a,5a,6,6a,6b,7,8,9,10,10a,11,12,12a,12b,12c-hexadecahydro-6b-(hydroxymethyl)-10,10,12a,12c-tetramethyl-, (3aR,5aR,6aS,6bR,10aS,12aR,12bS,12cS)- InChI=1/C26H38O4/c1-15(28)16-7-8-18-24(4)12-9-17-23(2,3)10-6-11-26(17,14-27)19(24)13-20-25(18,5)21(16)22(29)30-20/h7,17-21,27H,6,8-14H2,1-5H3/t17-,18-,19-,20+,21+,24-,25+,26+/m0/s1 VDBPCCVBAJLGOR-JWZWEURHBL 22-Hydroxy-24-methylsedn-16-en-24-one-12β,25β-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
8-Benzoyl-4-(1-hydroxy-1-methyl-ethyl)-9,9-dimethyl-1,10-bis-(3-methyl-but-2-enyl)-3-oxa-tricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione 5-benzoyl-2-(1-hydroxy-1-methylethyl)-6,6-dimethyl-7,9-bis(3-methylbut-2-en-1-yl)-3,5,6,7,8,9-hexahydro-5,9-methanocycloocta[b]furan-4,10(2H)-dione 5,9-methanocycloocta[b]furan-4,10(2H)-dione, 5-benzoyl-3,5,6,7,8,9-hexahydro-2-(1-hydroxy-1-methylethyl)-6,6-dimethyl-7,9-bis(3-methyl-2-butenyl)- InChI=1/C33H42O5/c1-20(2)14-15-23-19-32(17-16-21(3)4)28-24(18-25(38-28)31(7,8)37)27(35)33(29(32)36,30(23,5)6)26(34)22-12-10-9-11-13-22/h9-14,16,23,25,37H,15,17-19H2,1-8H3 PHBDYBJOGVFIQU-UHFFFAOYAL Ochrocarpinone C . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Phosphoric acid mono-{2-(14-carbamoyl-3,5-dihydroxy-1-methoxy-4,6,8,9,13-pentamethyl-tetradeca-7,9,13-trienyl)-9-hydroxy-4,4,8-trimethyl-7-[3-(2-methyl-oxazol-4-yl)-allyl]-1,6-dioxa-spiro[4.5]dec-3-yl} ester (2R,3R,5R,7S,8S,9S)-2-[(1S,7E,9E,13Z)-15-amino-3,5-dihydroxy-1-methoxy-4,6,8,9,13-pentamethyl-15-oxopentadeca-7,9,13-trien-1-yl]-9-hydroxy-4,4,8-trimethyl-7-[(2E)-3-(2-methyl-1,3-oxazol-4-yl)prop-2-en InChI=1/C39H63N2O12P/c1-22(17-34(40)44)13-11-14-23(2)24(3)18-25(4)35(45)27(6)30(42)19-33(49-10)36-37(53-54(46,47)48)38(8,9)39(52-36)20-31(43)26(5)32(51-39)16-12-15-29-21-50-28(7)41-29/h12,14-15,17-18,21,25-27,30-33,35-37,42-43,45H,11,13,16,19-20H2,1-10H3 GNMWTNFLWQSTKW-LCSBKJJSBS Geometricin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(2-Isopropenyl-5-methoxycarbonyl-7-oxo-oct-4-enyl)-2-methoxy-5-(2-oxo-propylidene)-2,5-dihydro-furan-3-carboxylic acid methyl ester methyl rel-(2R,5Z)-2-[(2S,4E)-2-isopropenyl-5-(methoxycarbonyl)-7-oxooct-4-en-1-yl]-2-methoxy-5-(2-oxopropylidene)-2,5-dihydrofuran-3-carboxylate 3-furancarboxylic acid, 2,5-dihydro-2-methoxy-2-[(2S,4E)-5-(methoxycarbonyl)-2-(1-methylethenyl)-7-oxo-4-octenyl]-5-(2-oxopropylidene)-, methyl ester, (2R,5Z)- InChI=1/C23H30O8/c1-14(2)18(9-8-17(10-15(3)24)21(26)28-5)13-23(30-7)20(22(27)29-6)12-19(31-23)11-16(4)25/h8,11-12,18H,1,9-10,13H2,2-7H3/b17-8+,19-11-/t18-,23+/m0/s1 DLDHIXFQQWPAHV-DBMFJDGMBW Seco-sethukarailin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4,8-Dihydroxy-5,5,7,9,13-pentamethyl-16-[1-methyl-2-(2-methyl-thiazol-4-yl)-vinyl]-oxacyclohexadec-13-ene-2,6-dione rel-(4R,7S,8R,9R,11E,13Z,16S)-4,8-dihydroxy-5,5,7,9,13-pentamethyl-16-[(E)-1-methyl-2-(2-methyl-1,3-thiazol-4-yl)vinyl]oxacyclohexadeca-11,13-diene-2,6-dione oxacyclohexadeca-11,13-diene-2,6-dione, 4,8-dihydroxy-5,5,7,9,13-pentamethyl-16-[(E)-1-methyl-2-(2-methyl-4-thiazolyl)ethenyl]-, (4S,7R,8S,9S,11E,13Z,16S)- InChI=1/C27H39NO5S/c1-16-9-8-10-17(2)25(31)19(4)26(32)27(6,7)23(29)14-24(30)33-22(12-11-16)18(3)13-21-15-34-20(5)28-21/h8-9,11,13,15,17,19,22-23,25,29,31H,10,12,14H2,1-7H3/b9-8+,16-11-,18-13+/t17-,19+,22+,23-,25-/m0/s1 AEAGZTSEFUFUKN-OKNXOETNBF 10,11-Didehydroepothilone D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,11-Dihydroxy-4,6a,10,10,13a,15b-hexamethyl-2,3,4,4a,5,6,6a,7,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-icosahydro-1H-cyclohepta[1,2-a;5,4-a']dinaphthalene-4-carboxylic acid rel-(3R,4S,6aR,11S,13aS,15bS)-3,11-dihydroxy-4,6a,10,10,13a,15b-hexamethyl-2,3,4,4a,5,6,6a,7,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-icosahydro-1H-naphtho[2',1':4,5]cyclohepta[1,2-a]naphthalene-4-carbo 1H-6,11b-(epoxymethano)phenanthro[3,2-b]furan-12-one, 2,3,4,4a,5,6,8,9-octahydro-11-hydroxy-4,4,8-trimethyl-, (8R,11bR)- InChI=1/C30H48O4/c1-26(2)20-9-7-18-17-27(3)14-11-22-29(5,16-13-24(32)30(22,6)25(33)34)21(27)10-8-19(18)28(20,4)15-12-23(26)31/h7,19-24,31-32H,8-17H2,1-6H3,(H,33,34)/t19?,20?,21?,22?,23-,24+,27+,28-,29-,30-/m1/s1 RGIWJHUJDHZDIN-UNVSLSIABO 3β-21β-dihydroxyserrat-14-en-24-oic acid Lycernuic acid A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(8R,11bR)-11-hydroxy-4,4,8-trimethyl-2,3,4,4a,5,6,8,9-octahydro-1H-6,11b-(epoxymethano)phenanthro[3,2-b]furan-12-one 1H-6,11b-(epoxymethano)phenanthro[3,2-b]furan-12-one, 2,3,4,4a,5,6,8,9-octahydro-11-hydroxy-4,4,8-trimethyl-, (8R,11bR)- InChI=1/C20H24O4/c1-10-9-23-17-11(10)7-12-13-8-14-19(2,3)5-4-6-20(14,18(22)24-13)15(12)16(17)21/h7,10,13-14,21H,4-6,8-9H2,1-3H3/t10-,13?,14?,20+/m0/s1 GNMZEYKZSUSJFQ-FDZGLVCHBX 12,16-Epoxycarnosol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
11-sec-Butyl-5,8-diisopropyl-2,6,14-trimethyl-15-propyl-12-oxa-20-thia-3,6,9,16,21-pentaaza-bicyclo[16.2.1]henicosa-1(21),18-diene-4,7,10,13,17-pentaone rel-(2R,5R,8R,11R,14R,15S)-5,8-diisopropyl-2,6,14-trimethyl-11-[(1S)-1-methylpropyl]-15-propyl-12-oxa-20-thia-3,6,9,16,21-pentaazabicyclo[16.2.1]henicosa-1(21),18-diene-4,7,10,13,17-pentone 12-oxa-20-thia-3,6,9,16,21-pentaazabicyclo[16.2.1]heneicosa-1(21),18-diene-4,7,10,13,17-pentone, 2,6,14-trimethyl-5,8-bis(1-methylethyl)-11-[(1R)-1-methylpropyl]-15-propyl-, (2S,5S,8S,11S,14S,15R)- InChI=1/C30H49N5O6S/c1-11-13-20-18(8)30(40)41-24(17(7)12-2)27(38)34-22(15(3)4)29(39)35(10)23(16(5)6)26(37)31-19(9)28-33-21(14-42-28)25(36)32-20/h14-20,22-24H,11-13H2,1-10H3,(H,31,37)(H,32,36)(H,34,38)/t17-,18+,19+,20-,22+,23+,24+/m1/s1 LOMSNBSLWHBACM-NFWWSSJYBB Ulongamide F . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 10-methoxy-8-oxo-9-(3,4,5-trimethoxy-phenyl)-5,5a,6,8,8a,9-hexahydro-furo[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl ester (5R,5aR,8aS,9R)-10-methoxy-8-oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl rel-acetate furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 9-(acetyloxy)-5,8,8a,9-tetrahydro-4-methoxy-5-(3,4,5-trimethoxyphenyl)-, (5R,5aS,8aR,9R)- InChI=1/C25H26O10/c1-11(26)35-21-13-8-17-23(34-10-33-17)24(31-5)19(13)18(20-14(21)9-32-25(20)27)12-6-15(28-2)22(30-4)16(7-12)29-3/h6-8,14,18,20-21H,9-10H2,1-5H3/t14-,18+,20+,21-/m0/s1 YYMZKKXIDKRNCK-XVPDYNCKBU (7R,8S,7’R,8’R)-(+)-7’-Acetyl-5’-methoxypicropodophyllin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1aR,3R,4S,4aS,7R,7aR,7bS)-1,1,4,7-tetramethyldecahydro-1H-cyclopropa[e]azulen-3-ol 1H-cycloprop[e]azulen-3-ol, decahydro-1,1,4,7-tetramethyl-, (1aR,3R,4S,4aS,7R,7aR,7bS)- InChI=1/C15H26O/c1-8-5-6-10-9(2)12(16)7-11-14(13(8)10)15(11,3)4/h8-14,16H,5-7H2,1-4H3/t8-,9+,10-,11-,12-,13-,14-/m1/s1 GVNNDIPIOZWPIP-XPGNYHPSBR (1S,10S)-9alpha-hydroxy-allo-aromadendrane . Information we have got: NMR spectra 13C, 1H, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1aR,4S,4aS,7R,7aR,7bS)-1,1,4,7-tetramethyldecahydro-3H-cyclopropa[e]azulen-3-one 3H-cycloprop[e]azulen-3-one, decahydro-1,1,4,7-tetramethyl-, (1aR,4S,4aS,7R,7aR,7bS)- InChI=1/C15H24O/c1-8-5-6-10-9(2)12(16)7-11-14(13(8)10)15(11,3)4/h8-11,13-14H,5-7H2,1-4H3/t8-,9+,10-,11-,13-,14-/m1/s1 GZWAUGUBRNNGII-AYDPQTPUBL (1S,10S)-allo-aromadendran-9-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1aR,3S,4R,7R,7aS,7bR)-1,1,4,7-tetramethyl-1a,2,3,4,6,7,7a,7b-octahydro-1H-cyclopropa[e]azulene-3,4-diol 1H-cycloprop[e]azulene-3,4-diol, 1a,2,3,4,6,7,7a,7b-octahydro-1,1,4,7-tetramethyl-, (1aR,3S,4R,7R,7aS,7bR)- InChI=1/C15H24O2/c1-8-5-6-9-12(8)13-10(14(13,2)3)7-11(16)15(9,4)17/h6,8,10-13,16-17H,5,7H2,1-4H3/t8-,10-,11+,12-,13-,15-/m1/s1 WLUGOAQHXUWZRE-UOHJYFIVBZ 9beta,10beta-dihydroxyaromadendr-1-ene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1aR,3S,5R,7R,7aS,7bR)-1,1,4,7-tetramethyl-1a,2,3,5,6,7,7a,7b-octahydro-1H-cyclopropa[e]azulene-3,5-diol 1H-cycloprop[e]azulene-3,5-diol, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,4,7-tetramethyl-, (1aR,3S,5R,7R,7aS,7bR)- InChI=1/C15H24O2/c1-7-5-11(17)13-8(2)10(16)6-9-14(12(7)13)15(9,3)4/h7,9-12,14,16-17H,5-6H2,1-4H3/t7-,9-,10+,11-,12-,14-/m1/s1 FYFASYNQICBPRL-OJRKOUOBBU 2beta,9beta-dihydroxyaromadendr-1(10)-ene . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1aR,3S,4S,4aR,5R,7R,7aS,7bR)-1,1,4,7-tetramethyldecahydro-4aH-cyclopropa[e]azulene-3,4,4a,5-tetrol 4aH-cycloprop[e]azulene-3,4,4a,5-tetrol, decahydro-1,1,4,7-tetramethyl-, (1aR,3S,4S,4aR,5R,7R,7aS,7bR)- InChI=1/C15H26O4/c1-7-5-10(17)15(19)11(7)12-8(13(12,2)3)6-9(16)14(15,4)18/h7-12,16-19H,5-6H2,1-4H3/t7-,8-,9+,10-,11+,12-,14+,15+/m1/s1 BKHAWRYCEWUVGR-WPPZQSEWBK (1S,10S)-1alpha,2beta,9beta,10beta-tetahydroxyaromadendrane . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 1,3,9-trihydroxy-2-isopropyl-4b,8,8-trimethyl-10-oxo-4b,5,6,7,8,10-hexahydro-phenanthren-4-yl ester 6,12,14-trihydroxy-7-oxoabieta-5,8,11,13-tetraen-11-yl acetate 9(1H)-phenanthrenone, 5-(acetyloxy)-2,3,4,4a-tetrahydro-6,8,10-trihydroxy-1,1,4a-trimethyl-7-(1-methylethyl)-, (4aS)- InChI=1/C22H28O6/c1-10(2)12-15(24)13-14(19(17(12)26)28-11(3)23)22(6)9-7-8-21(4,5)20(22)18(27)16(13)25/h10,24,26-27H,7-9H2,1-6H3/t22-/m1/s1 DFFRVBOOGZCQDV-JOCHJYFZBS 11-acetoxy-6,12,14-trihydroxy-abieta-5,8,11,13-tetraen-7-one Coleon U 11-acetate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(2alpha,12alpha,13beta)-6-hydroxy-7,11,14-trioxo-13,17-cycloabieta-5,8-diene-2,12-diyl diacetate spiro[cyclopropane-1,2'(1'H)-phenanthrene]-1',4',10'(3'H,6'H)-trione, 3',6'-bis(acetyloxy)-4'b,5',7',8'-tetrahydro-9'-hydroxy-2,4'b,8',8'-tetramethyl-, (1S,3'R,4b'S,6'S)- InChI=1/C24H28O8/c1-10-7-24(10)20(30)14-15(17(28)21(24)32-12(3)26)23(6)9-13(31-11(2)25)8-22(4,5)19(23)18(29)16(14)27/h10,13,21,29H,7-9H2,1-6H3/t10?,13-,21-,23+,24+/m0/s1 ZEYSITWNHCCRCY-VQLMOZIMBE (13S,15S)-2α,12α-diacetoxy-6-hydroxy-13,16-cycloabieta-5,8-dien-7,11,14-trione Xanthanthusin I . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,7-Dihydroxy-2-phenyl-6-(3-phenyl-allyl)-chromen-4-one 5,7-dihydroxy-2-phenyl-6-[(2E)-3-phenylprop-2-en-1-yl]-4H-chromen-4-one 4H-1-benzopyran-4-one, 5,7-dihydroxy-2-phenyl-6-[(2E)-3-phenyl-2-propenyl]- InChI=1/C24H18O4/c25-19-14-22-23(20(26)15-21(28-22)17-11-5-2-6-12-17)24(27)18(19)13-7-10-16-8-3-1-4-9-16/h1-12,14-15,25,27H,13H2/b10-7+ BAHFSEZASCPWAI-JXMROGBWBJ 6-cinnamylchrysin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Methyl-butyric acid 5,7-dihydroxy-4-oxo-2-phenyl-chroman-3-yl ester (2R,3R)-5,7-dihydroxy-4-oxo-2-phenyl-3,4-dihydro-2H-chromen-3-yl rel-(2S)-2-methylbutanoate butanoic acid, 2-methyl-, (2R,3R)-3,4-dihydro-5,7-dihydroxy-4-oxo-2-phenyl-2H-1-benzopyran-3-yl ester, (2S)- InChI=1/C20H20O6/c1-3-11(2)20(24)26-19-17(23)16-14(22)9-13(21)10-15(16)25-18(19)12-7-5-4-6-8-12/h4-11,18-19,21-22H,3H2,1-2H3/t11-,18+,19-/m0/s1 ZDDSHWOLTYMTJG-SYURPWHHBE 3-O-[(S)-2-methylbutyroyl]pinobanksin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
nona-2,6-dienal (2E,6Z)-nona-2,6-dienal 2,6-nonadienal, (2E,6Z)- InChI=1/C9H14O/c1-2-3-4-5-6-7-8-9-10/h3-4,7-9H,2,5-6H2,1H3/b4-3-,8-7+ HZYHMHHBBBSGHB-ODYTWBPABQ (2E,6Z)-nona-2,6-dien-1-al nona-2-trans-6-cis-dienal nona-2t,6c-dienal nonadien-(2t.6c)-al-(1) trans-2,cis-6-nonadienal . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-hydroxy-3H-isobenzofuran-1-one 3-hydroxy-2-benzofuran-1(3H)-one 1(3H)-isobenzofuranone, 3-hydroxy- InChI=1/C8H6O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h1-4,7,9H JKNKNWJNCOJPLI-UHFFFAOYAH 2-formyl-benzoic acid 2-formyl-benzoic acid, lactol form 3-hydroxy-1(3H)-isobenzofuranone 3-hydroxy-3H-isobenzofuran-1-one phthalaldehydic acid . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(4-hydroxy-3-methoxy-phenyl)-butan-2-one 4-(4-hydroxy-3-methoxyphenyl)butan-2-one 2-butanone, 4-(4-hydroxy-3-methoxyphenyl)- InChI=1/C11H14O3/c1-8(12)3-4-9-5-6-10(13)11(7-9)14-2/h5-7,13H,3-4H2,1-2H3 OJYLAHXKWMRDGS-UHFFFAOYAN 4-(4-hydroxy-3-methoxy-phenyl)-butan-2-one Zingerone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1alpha,3alpha,5xi,6alpha,9xi,10xi,14alpha,15alpha,16beta)-8-(acetyloxy)-20-ethyl-3,13,15-trihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl benzoate aconitane-3,8,13,14,15-pentol, 20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)-, 8-acetate 14-benzoate, (1alpha,3alpha,5xi,6alpha,9xi,10xi,14alpha,15alpha,16beta)- InChI=1/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19?,20-,21+,22?,23+,24+,25?,26-,27+,28-,29+,3 XFSBVAOIAHNAPC-OFTUODICBS Aconitine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-isopropenyl-1-methyl-1,2,3,4,5,6,7,8-octahydro-naphthalene-2,3-diol rel-(1R,2S,3S,7S)-7-isopropenyl-1-methyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2,3-diol 2,3-naphthalenediol, 1,2,3,4,5,6,7,8-octahydro-1-methyl-7-(1-methylethenyl)-, (1S,2R,3R,7R)- InChI=1/C14H22O2/c1-8(2)10-4-5-11-7-13(15)14(16)9(3)12(11)6-10/h9-10,13-16H,1,4-7H2,2-3H3/t9-,10+,13+,14+/m0/s1 XSCYYIVXGBKTOC-GZZJDILIBY Rishitin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
isobutyric acid 6-formyl-10-methyl-3-methylene-2-oxo-2,3,3a,4,9,11a-hexahydro-cyclodeca[b]furan-4-yl ester (4R,5E,7Z,10Z,11aR)-6-formyl-10-methyl-3-methylene-2-oxo-2,3,3a,4,9,11a-hexahydrocyclodeca[b]furan-4-yl rel-2-methylpropanoate propanoic acid, 2-methyl-, (4R,5E,7Z,10Z,11aR)-6-formyl-2,3,3a,4,9,11a-hexahydro-10-methyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester InChI=1/C19H22O5/c1-11(2)18(21)23-16-9-14(10-20)7-5-6-12(3)8-15-17(16)13(4)19(22)24-15/h5,7-11,15-17H,4,6H2,1-3H3/b7-5-,12-8-,14-9+/t15-,16-,17?/m1/s1 DOLGCPLAINMHSM-NUTGQILEBT Acanthostral . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,1,4,7-tetramethyl-decahydro-cyclopropa[e]azulen-4-ol rel-(1aR,4R,7R,7bS)-1,1,4,7-tetramethyldecahydro-1H-cyclopropa[e]azulen-4-ol 1H-cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, (1aS,4S,7S,7bR)- InChI=1/C15H26O/c1-9-5-6-10-12(9)13-11(14(13,2)3)7-8-15(10,4)16/h9-13,16H,5-8H2,1-4H3/t9-,10?,11-,12?,13-,15-/m0/s1 AYXPYQRXGNDJFU-WJOAHUTCBJ Ledol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-(1-hydroxy-2,6,6-trimethyl-4-oxo-cyclohex-2-enyl)-3-methyl-penta-2,4-dienoic acid (2Z,4E)-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid 2,4-pentadienoic acid, 5-(1-hydroxy-2,6,6-trimethyl-4-oxo-2-cyclohexen-1-yl)-3-methyl-, (2Z,4E)- InChI=1/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7- JLIDBLDQVAYHNE-LXGGSRJLBS (+)-2-cis,4-trans-abscisic acid (+)-abscisic acid (S-(Z,E))-5-(1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid Abscisic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(2aR,3aR,5aS,5bS,11aS,13bS)-2a-isopropyl-5a,5b,8,8,11a,13b-hexamethyloctadecahydrophenanthro[2',1':4,5]indeno[1,7a-b]oxiren-9(1H)-one phenanthro[2',1':4,5]indeno[1,7a-b]oxiren-9(1H)-one, octadecahydro-5a,5b,8,8,11a,13b-hexamethyl-2a-(1-methylethyl)-, (2aS,3aS,5aR,5bR,11aR,13bR)- InChI=1/C30H48O2/c1-19(2)29-17-15-28(8)22-10-9-21-25(5)13-12-23(31)24(3,4)20(25)11-14-26(21,6)27(22,7)16-18-30(28,29)32-29/h19-22H,9-18H2,1-8H3/t20?,21?,22?,25-,26+,27+,28+,29-,30-/m0/s1 CMWZPPYBIGXKPR-UAPSMVLGBG 17β,21β-Epoxyhopan-3-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-Isopropyl-7-methyl-3-methylene-octahydro-cyclopenta[1,3]cyclopropa[1,2]benzene rel-(4R,7S)-4-isopropyl-7-methyl-3-methyleneoctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzene 1H-cyclopenta[1,3]cyclopropa[1,2]benzene, octahydro-7-methyl-3-methylene-4-(1-methylethyl)-, (4S,7R)- InChI=1/C15H24/c1-9(2)12-6-5-11(4)15-8-7-10(3)13(15)14(12)15/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12+,13?,14?,15?/m1/s1 FSRZGYRCMPZNJF-MDKBLUTQBR β-Cubebene 6-epi-β-Cubebene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Amino-5-(4-amino-5-carboxy-3,6-dioxo-cyclohexa-1,4-dienyl)-6-hydroxy-3-methoxy-benzoic acid 2-amino-5-(4-amino-5-carboxy-3,6-dioxocyclohexa-1,4-dien-1-yl)-6-hydroxy-3-methoxybenzoic acid benzoic acid, 2-amino-5-(4-amino-5-carboxy-3,6-dioxo-1,4-cyclohexadien-1-yl)-6-hydroxy-3-methoxy- InChI=1/C15H12N2O8/c1-25-7-3-5(13(20)9(11(7)17)15(23)24)4-2-6(18)10(16)8(12(4)19)14(21)22/h2-3,20H,16-17H2,1H3,(H,21,22)(H,23,24) JPIGYSPCEWSTHY-UHFFFAOYAQ Blennione . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Octa-2,4-dienoic acid 5-(5-hydroxy-octyl)-2-methyl-decahydro-quinolin-3-yl ester (2R,3S,5R)-5-(5-hydroxyoctyl)-2-methyldecahydroquinolin-3-yl rel-(2E,4E)-octa-2,4-dienoate 2,4-octadienoic acid, (2S,3R,5S)-decahydro-5-(5-hydroxyoctyl)-2-methyl-3-quinolinyl ester, (2E,4E)- InChI=1/C26H45NO3/c1-4-6-7-8-9-18-26(29)30-25-19-23-21(14-10-11-16-22(28)13-5-2)15-12-17-24(23)27-20(25)3/h7-9,18,20-25,27-28H,4-6,10-17,19H2,1-3H3/b8-7+,18-9+/t20-,21-,22?,23?,24?,25+/m0/s1 RLTXIRPCJHXWEP-CRHKOZJVBH Lepadin H . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Isopropyl-3a,7a-dimethyl-3a,4,5,6,7,7a-hexahydro-1H-4,7-methano-indene rel-(3aR,4S,7R,7aS)-3-isopropyl-3a,7a-dimethyl-3a,4,5,6,7,7a-hexahydro-1H-4,7-methanoindene 4,7-methano-1H-indene, 3a,4,5,6,7,7a-hexahydro-3a,7a-dimethyl-3-(1-methylethyl)-, (3aS,4R,7S,7aR)- InChI=1/C15H24/c1-10(2)13-7-8-14(3)11-5-6-12(9-11)15(13,14)4/h7,10-12H,5-6,8-9H2,1-4H3/t11-,12+,14+,15+/m0/s1 ZGKPBXWQOYDEMA-CTHBEMJXBM Petasitene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(3R,3aR,6R,7R,8R,10aR,11R,13aR,13bS,14bR)-6,8-dihydroxy-3,6,8,11,14,15-hexamethyl-3,3a,4,5,6,6a,6b,7,7a,8,9,10,10a,13a,13c,14b-hexadecahydro-2H-7,13b-ethenofuro[2'',3'':4',5']azuleno[1',2':2,3]azu 2H-7,13b-ethenofuro[2'',3'':4',5']azuleno[1',2':2,3]azuleno[4,5-b]furan-2,12(11H)-dione, 3,3a,4,5,6,6a,6b,7,7a,8,9,10,10a,13a,13c,14b-hexadecahydro-6,8-dihydroxy-3,6,8,11,14,15-hexamethyl-, (3aS,6S,7S InChI=1/C30H40O6/c1-12-11-18-20-21(30(12)24(18)29(6,34)10-8-17-14(3)27(32)36-25(17)30)15(4)19-22(20)28(5,33)9-7-16-13(2)26(31)35-23(16)19/h11,13-14,16-18,20-25,33-34H,7-10H2,1-6H3/t13-,14-,16-,17-,18+,20?,21?,22?,23-,24?,25-,28-,29-,30+/m0/s1 PZHWYURJZAPXAN-HIXOCCILBI Absinthin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5a,11a-dihydro-5H-[1,3]dioxolo[4,5-h][1,3]dioxolo[5,6][1]benzofuro[3,2-c]chromene 5H-1,3-dioxolo[4,5-h][1,3]dioxolo[5,6]benzofuro[3,2-c][1]benzopyran, 5a,11a-dihydro- InChI=1/C17H12O6/c1-2-11-17(22-7-19-11)16-8(1)15-10(5-18-16)9-3-13-14(21-6-20-13)4-12(9)23-15/h1-4,10,15H,5-7H2 XEVNFKSGEIUCCG-UHFFFAOYAN 3,4:8,9-Dimethylenedioxypterocarpan . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(2R,3R)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-9H-[1,4]dioxino[2,3-h]chromen-9-one 9H-pyrano[2,3-f]-1,4-benzodioxin-9-one, 2,3-dihydro-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-, (2R,3R)- InChI=1/C20H18O8/c1-24-13-7-11(8-14(25-2)17(13)23)18-15(9-21)27-20-12(26-18)5-3-10-4-6-16(22)28-19(10)20/h3-8,15,18,21,23H,9H2,1-2H3/t15-,18-/m1/s1 QLFQDIADUIVNRF-CRAIPNDOBI Daphneticin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,5,7-trihydroxy-1-oxo-6-[(4E)-3-oxotetradec-4-en-1-yl]-1,3-dihydro-2-benzofuran-4-carbaldehyde 4-isobenzofurancarboxaldehyde, 1,3-dihydro-3,5,7-trihydroxy-1-oxo-6-[(4E)-3-oxo-4-tetradecenyl]- InChI=1/C23H30O7/c1-2-3-4-5-6-7-8-9-10-11-15(25)12-13-16-20(26)17(14-24)18-19(21(16)27)23(29)30-22(18)28/h10-11,14,22,26-28H,2-9,12-13H2,1H3/b11-10+ IPXWNHKZNHVKLL-ZHACJKMWBF Xylaral . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,8-dihydroxy-3-(hydroxymethyl)anthra-9,10-quinone 9,10-anthracenedione, 1,8-dihydroxy-3-(hydroxymethyl)- InChI=1/C15H10O5/c16-6-7-4-9-13(11(18)5-7)15(20)12-8(14(9)19)2-1-3-10(12)17/h1-5,16-18H,6H2 YDQWDHRMZQUTBA-UHFFFAOYAS 1,8-dihydroxy-3-(hydroxymethyl)-9,10-anthracenedione 1,8-dihydroxy-3-hydroxymethyl-anthraquinone Aloe-emodin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(5-hept-4-en-2-ynoyl-furan-2-yl)-acrylic acid methyl ester methyl (2E)-3-{5-[(4Z)-hept-4-en-2-ynoyl]-2-furyl}acrylate 2-propenoic acid, 3-[5-[(4Z)-1-oxo-4-hepten-2-ynyl]-2-furanyl]-, methyl ester, (2E)- InChI=1/C15H14O4/c1-3-4-5-6-7-13(16)14-10-8-12(19-14)9-11-15(17)18-2/h4-5,8-11H,3H2,1-2H3/b5-4-,11-9+ NQZCQIDFBYCBAU-JHGYFVHDBE Wyerone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1,2,3,6,7,8-Hexahydroxy-10-oxo-9,10-dihydro-anthracen-9-yl)-acetic acid methyl ester methyl (1,2,3,6,7,8-hexahydroxy-10-oxo-9,10-dihydroanthracen-9-yl)acetate 9-anthraceneacetic acid, 9,10-dihydro-1,2,3,6,7,8-hexahydroxy-10-oxo-, methyl ester InChI=1/C17H14O9/c1-26-10(20)4-5-11-6(2-8(18)14(22)16(11)24)13(21)7-3-9(19)15(23)17(25)12(5)7/h2-3,5,18-19,22-25H,4H2,1H3 SBGSBMMAAXSLCF-UHFFFAOYAM Rubanthrone B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(3,4,5-Trimethoxy-8,8-dimethyl-3,4-dihydro-2H,8H-pyrano[3,2-g]chromen-2-yl)-phenol 4-(5,6,7-trimethoxy-2,2-dimethyl-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-8-yl)phenol 9,19-cyclolanost-24-ene-3,23-diol, (3beta,5xi,8xi,9beta,23S)- InChI=1/C23H26O6/c1-23(2)11-10-15-16(29-23)12-17-18(20(15)25-3)21(26-4)22(27-5)19(28-17)13-6-8-14(24)9-7-13/h6-12,19,21-22,24H,1-5H3 KAMSUIMVPLJLGA-UHFFFAOYAS 3β,4β,-5-Trimethoxy-4'-hydroxy-(7,6:2",3")-6",6"-dimethylpyranoflavan . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
17-(3-Hydroxy-1,5-dimethyl-hex-4-enyl)-4,4,13,14-tetramethyl-tetradecahydro-cyclopropa[9,10]cyclopenta[a]phenanthren-3-ol (3beta,5xi,8xi,9beta,23S)-9,19-cyclolanost-24-ene-3,23-diol 9,19-cyclolanost-24-ene-3,23-diol, (3beta,5xi,8xi,9beta,23S)- InChI=1/C30H50O2/c1-19(2)16-21(31)17-20(3)22-10-12-28(7)24-9-8-23-26(4,5)25(32)11-13-29(23)18-30(24,29)15-14-27(22,28)6/h16,20-25,31-32H,8-15,17-18H2,1-7H3/t20-,21-,22-,23?,24?,25+,27-,28+,29-,30+/m1/s1 GCFZSJAFEVXDNW-YWLNMDIGBL (23S*)-cycloart-24-ene-3β,23-diol (23S*)-cycloarta-24-en-3β,23-diol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
17-(2,5-Dihydroxy-1,5-dimethyl-hex-3-enyl)-4,4,13,14-tetramethyl-tetradecahydro-cyclopropa[9,10]cyclopenta[a]phenanthren-3-one (5xi,8xi,9beta,23E)-22,25-dihydroxy-9,19-cyclolanost-23-en-3-one 9,19-cyclolanost-23-en-3-one, 22,25-dihydroxy-, (5xi,8xi,9beta,23E)- InChI=1/C30H48O3/c1-19(21(31)11-13-25(2,3)33)20-10-14-28(7)23-9-8-22-26(4,5)24(32)12-15-29(22)18-30(23,29)17-16-27(20,28)6/h11,13,19-23,31,33H,8-10,12,14-18H2,1-7H3/b13-11+/t19-,20+,21?,22?,23?,27+,28-,29+,30-/m0/s1 FGKUHDXMDDMVEC-FXOGCNDFBQ 22,25-dihydroxycycloart-23E-en-3-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(2R,5R,6S,2'S,5'R,6'S)-2,2'-tetrahydrofuran-2,5-diylbis[6-(3,4-dimethylpent-4-en-1-yl)-2,5,6-trimethyltetrahydro-2H-pyran] 2H-pyran, 2,2'-(tetrahydro-2,5-furandiyl)bis[6-(3,4-dimethyl-4-pentenyl)tetrahydro-2,5,6-trimethyl-, (2R,5R,6S,2'S,5'R,6'S)- InChI=1/C34H60O3/c1-23(2)25(5)15-19-31(9)27(7)17-21-33(11,36-31)29-13-14-30(35-29)34(12)22-18-28(8)32(10,37-34)20-16-26(6)24(3)4/h25-30H,1,3,13-22H2,2,4-12H3/t25?,26?,27-,28-,29?,30?,31+,32+,33-,34+/m1/s1 MFRQZVAPWAKQJT-KJAYROKIBL Botryolin B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Hydroxy-3-(4-hydroxy-phenyl)-acrylic acid (2Z)-2-hydroxy-3-(4-hydroxyphenyl)acrylic acid 2-propenoic acid, 2-hydroxy-3-(4-hydroxyphenyl)-, (2Z)- InChI=1/C9H8O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-5,10-11H,(H,12,13)/b8-5- GQYBCIHRWMPOOF-YVMONPNEBP 4,α-dihydroxy-cinnamic acid p-Hydroxyphenylpyruvic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,6,6-trimethyl-bicyclo[3.1.1]heptan-3-ol 2,6,6-trimethylbicyclo[3.1.1]heptan-3-ol bicyclo[3.1.1]heptan-3-ol, 2,6,6-trimethyl- InChI=1/C10H18O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-9,11H,4-5H2,1-3H3 REPVLJRCJUVQFA-UHFFFAOYAW (2exoH)-pinan-3exo-ol cis-pinocampheol isopinocampheol . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,2-dimethoxy-4-(2-nitro-propenyl)-benzene 1,2-dimethoxy-4-[(1E)-2-nitroprop-1-en-1-yl]benzene benzene, 1,2-dimethoxy-4-[(1E)-2-nitro-1-propenyl]- InChI=1/C11H13NO4/c1-8(12(13)14)6-9-4-5-10(15-2)11(7-9)16-3/h4-7H,1-3H3/b8-6+ JGFBGRHDJMANRR-SOFGYWHQBC 1,2-dimethoxy-4-(2-nitro-1-propenyl)-benzene 1,2-dimethoxy-4-(2-nitro-propenyl)-benzene 1-(3,4-dimethoxyphenyl)-2-nitropropene 3,4-dimethoxy-β-methyl-β-nitrostyrene . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,6,6-trimethyl-bicyclo[3.1.1]hept-2-ene 2,6,6-trimethylbicyclo[3.1.1]hept-2-ene bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl- InChI=1/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3 GRWFGVWFFZKLTI-UHFFFAOYAF ALPHA-PINENE (DL) . Information we have got: NMR spectra 13C, 13C, 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-(7-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-ethanone 1-(7-hydroxy-2,2-dimethyl-2H-chromen-6-yl)ethanone ethanone, 1-(7-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)- InChI=1/C13H14O3/c1-8(14)10-6-9-4-5-13(2,3)16-12(9)7-11(10)15/h4-7,15H,1-3H3 SVUVYHFYZBCYRF-UHFFFAOYAF Eupatoriochromene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6,7-dimethoxy-2,2-dimethyl-2H-chromene 6,7-dimethoxy-2,2-dimethyl-2H-chromene 2H-1-benzopyran, 6,7-dimethoxy-2,2-dimethyl- InChI=1/C13H16O3/c1-13(2)6-5-9-7-11(14-3)12(15-4)8-10(9)16-13/h5-8H,1-4H3 PTIDGSWTMLSGAH-UHFFFAOYAR 6,7-dimethoxy-2,2-dimethyl2H-1-benzopyran Preconene II . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-[6-(2-Carboxy-ethyl)-2-hydroxy-7-isopropenyl-3a,6,9b-trimethyl-2,3,3a,4,5,6,7,8,9,9b-decahydro-1H-cyclopenta[a]naphthalen-3-yl]-6-methyl-hept-5-enoic acid rel-(2R)-2-[(2R,3R,3aR,6S,9bR)-6-(2-carboxyethyl)-2-hydroxy-7-isopropenyl-3a,6,9b-trimethyl-2,3,3a,4,5,6,7,8,9,9b-decahydro-1H-cyclopenta[a]naphthalen-3-yl]-6-methylhept-5-enoic acid 1H-benz[e]indene-6-propanoic acid, 3-(1-carboxy-5-methyl-4-hexenyl)-2,3,3a,4,5,6,7,8,9,9b-decahydro-2-hydroxy-3a,6,9b-trimethyl-7-(1-methylethenyl)-, (2R,3R,3aR,6S,9bR)- InChI=1/C30H46O5/c1-18(2)9-8-10-20(27(34)35)26-24(31)17-30(7)23-12-11-21(19(3)4)28(5,15-14-25(32)33)22(23)13-16-29(26,30)6/h9,20-21,24,26,31H,3,8,10-17H2,1-2,4-7H3,(H,32,33)(H,34,35)/t20-,21?,24-,26+,28+,29-,30+/m1/s1 VPTZOSBKEDUOFE-TWVOARTJBC Poricoic acid G . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Hydroxy-5-isobutyryl-6-methyl-1,3,7-tris-(3-methyl-but-2-enyl)-6-(4-methyl-pent-3-enyl)-bicyclo[3.3.1]nonane-2,4,9-trione rel-(1R,3R,5R,6S,7R)-3-hydroxy-5-isobutyryl-6-methyl-1,3,7-tris(3-methylbut-2-en-1-yl)-6-(4-methylpent-3-en-1-yl)bicyclo[3.3.1]nonane-2,4,9-trione bicyclo[3.3.1]nonane-2,4,9-trione, 3-hydroxy-6-methyl-1,3,7-tris(3-methyl-2-butenyl)-5-(2-methyl-1-oxopropyl)-6-(4-methyl-3-pentenyl)-, (1S,3S,5S,6R,7S)- InChI=1/C35H52O5/c1-22(2)13-12-18-32(11)27(15-14-23(3)4)21-33(19-16-24(5)6)29(37)34(40,20-17-25(7)8)31(39)35(32,30(33)38)28(36)26(9)10/h13-14,16-17,26-27,40H,12,15,18-21H2,1-11H3/t27-,32+,33+,34-,35+/m0/s1 YCLWQYWJILHRAA-QJTMTUCMBM 8α-Hydroxyhyperforin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 8-bromo-6-hydroxy-3,4a,7,7,10a-pentamethyl-3-vinyl-dodecahydro-benzo[f]chromen-10-yl ester (3R,4aS,6S,8R,10S,10aR,10bS)-8-bromo-6-hydroxy-3,4a,7,7,10a-pentamethyl-3-vinyldodecahydro-1H-benzo[f]chromen-10-yl rel-acetate 1H-naphtho[2,1-b]pyran-6,10-diol, 8-bromo-3-ethenyldodecahydro-3,4a,7,7,10a-pentamethyl-, 10-acetate, (3R,4aS,6S,8R,10S,10aR,10bS)- InChI=1/C22H35BrO4/c1-8-20(5)10-9-15-21(6,27-20)12-14(25)18-19(3,4)16(23)11-17(22(15,18)7)26-13(2)24/h8,14-18,25H,1,9-12H2,2-7H3/t14-,15+,16+,17-,18?,20-,21-,22+/m0/s1 JPPHIVOLANTITC-WCYJOZPLBH 1-Acetoxy-3-bromo-6-hydroxy-8,13-epoxylabd-14-ene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-[2-(3-Hydroxy-2-methoxy-phenyl)-ethyl]-5-methoxy-2-methyl-phenol 3-[2-(3-hydroxy-2-methoxyphenyl)ethyl]-5-methoxy-2-methylphenol phenol, 3-[2-(3-hydroxy-2-methoxyphenyl)ethyl]-5-methoxy-2-methyl- InChI=1/C17H20O4/c1-11-13(9-14(20-2)10-16(11)19)8-7-12-5-4-6-15(18)17(12)21-3/h4-6,9-10,18-19H,7-8H2,1-3H3 XCEKLBSFNZXDES-UHFFFAOYAF Stilbostemin F . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Propionic acid 9-acetoxy-8,8-dimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-10-yl ester 9-(acetyloxy)-8,8-dimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-10-yl propionate 4H-1-benzopyran-4-one, 6-[(1S,2R)-2-(3,6-dihydro-6-oxo-2H-pyran-2-yl)-2-hydroxy-1-phenylethyl]-2,3-dihydro-5,7-dihydroxy-2-phenyl-, (2S)- InChI=1/C19H20O7/c1-5-13(21)24-17-15-12(26-19(3,4)18(17)23-10(2)20)8-6-11-7-9-14(22)25-16(11)15/h6-9,17-18H,5H2,1-4H3 IGMRYMQUDCGCFD-UHFFFAOYAT Propionic acid (9R,10R)-9-acetoxy-8,8-dimethyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-2-one-10-yl ester . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,7-Dihydroxy-6-[2-hydroxy-2-(6-oxo-3,6-dihydro-2H-pyran-2-yl)-1-phenyl-ethyl]-2-phenyl-chroman-4-one rel-(2R)-5,7-dihydroxy-6-[(1R,2S)-2-hydroxy-2-(6-oxo-3,6-dihydro-2H-pyran-2-yl)-1-phenylethyl]-2-phenyl-2,3-dihydro-4H-chromen-4-one 4H-1-benzopyran-4-one, 6-[(1S,2R)-2-(3,6-dihydro-6-oxo-2H-pyran-2-yl)-2-hydroxy-1-phenylethyl]-2,3-dihydro-5,7-dihydroxy-2-phenyl-, (2S)- InChI=1/C28H24O7/c29-18-14-21(16-8-3-1-4-9-16)34-22-15-19(30)26(28(33)25(18)22)24(17-10-5-2-6-11-17)27(32)20-12-7-13-23(31)35-20/h1-11,13,15,20-21,24,27,30,32-33H,12,14H2/t20?,21-,24-,27-/m0/s1 NVXSIKNLZGNCDG-OZWVUVOVBA Goniolactone B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-Isopropenyl-1,4a-dimethyl-decahydro-naphthalen-1-ylamine 7-isopropenyl-1,4a-dimethyldecahydronaphthalen-1-amine 1-naphthalenamine, decahydro-1,4a-dimethyl-7-(1-methylethenyl)- InChI=1/C15H27N/c1-11(2)12-6-9-14(3)7-5-8-15(4,16)13(14)10-12/h12-13H,1,5-10,16H2,2-4H3 IEHDMDFZDJQIHW-UHFFFAOYAH (4R*,5R*,7S*,10R*)-4-Aminoeudesm-11-ene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Hydroxymethyl-7,11-dimethyl-cyclododeca-2,6,10-trienol (2E,6E,10E)-3-(hydroxymethyl)-7,11-dimethylcyclododeca-2,6,10-trien-1-ol 1,5,9-cyclododecatriene-1-methanol, 3-hydroxy-5,9-dimethyl-, (1E,3R,5E,9E)- InChI=1/C15H24O2/c1-12-5-3-7-13(2)9-15(17)10-14(11-16)8-4-6-12/h6-7,10,15-17H,3-5,8-9,11H2,1-2H3/b12-6+,13-7+,14-10+/t15-/m1/s1 RCJTUBLQPQRESN-FJOWFKQPBA Guatterin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6,9,12-Trimethyl-tetradeca-2,4,8,10-tetraenoic acid methyl ester methyl rel-(2E,4E,6R,8E,10E,12R)-6,9,12-trimethyltetradeca-2,4,8,10-tetraenoate 2,4,8,10-tetradecatetraenoic acid, 6,9,12-trimethyl-, methyl ester, (2E,4E,6S,8E,10E,12S)- InChI=1/C18H28O2/c1-6-15(2)11-12-17(4)14-13-16(3)9-7-8-10-18(19)20-5/h7-12,14-16H,6,13H2,1-5H3/b9-7+,10-8+,12-11+,17-14+/t15-,16+/m0/s1 DLNJQMUZKSNTET-JMXAGWQHBH Methyl (2E,4E,6S,8E,10E,12S)-6,9,12-trimethyltetradeca-2,4,8,10-tetraenoate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,5,15-Trimethyl-7-methylene-hexadeca-2,10,12-trienoic acid methyl ester methyl (2E,10E,12E)-3,5,15-trimethyl-7-methylenehexadeca-2,10,12-trienoate 2,10,12-hexadecatrienoic acid, 3,5,15-trimethyl-7-methylene-, methyl ester, (2E,5R,10E,12E)- InChI=1/C21H34O2/c1-17(2)12-10-8-7-9-11-13-18(3)14-19(4)15-20(5)16-21(22)23-6/h7-10,16-17,19H,3,11-15H2,1-2,4-6H3/b9-7+,10-8+,20-16+/t19-/m1/s1 IHHOSMKJYXHFAB-VLCGKGKVBA Methyl (2E,5R,10E,12E)-3,5,15-trimethyl-7-methylene-hexadeca-2,10,12-trienoate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,3,4-Trimethyl-2,3-dihydro-benzofuran-5,7-diol rel-(2R,3S)-2,3,4-trimethyl-2,3-dihydro-1-benzofuran-5,7-diol 5,7-benzofurandiol, 2,3-dihydro-2,3,4-trimethyl-, (2S,3R)- InChI=1/C11H14O3/c1-5-7(3)14-11-9(13)4-8(12)6(2)10(5)11/h4-5,7,12-13H,1-3H3/t5-,7-/m0/s1 SASOPTOEUQXKMB-FSPLSTOPBD 2,3,4-Trimethyl-5,7-dihydroxy-2,3-dihydrobenzofuran . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(3R,6R,9R,11R)-11-acetyl-9-isopropenyloctahydro-1H-3,6-methanobenzo[3,4]cyclohepta[1,2-c]furan-1,5,7(3H,4H)-trione 3,6-methano-1H-benzo[3,4]cyclohepta[1,2-c]furan-1,5,7(3H,4H)-trione, 11-acetyloctahydro-9-(1-methylethenyl)-, (3S,6S,9S,11S)- InChI=1/C19H22O5/c1-7(2)9-4-10-15-11-6-13(22)17(16(10)12(21)5-9)14(8(3)20)18(11)24-19(15)23/h9-11,14-18H,1,4-6H2,2-3H3/t9-,10?,11?,14-,15?,16?,17+,18-/m0/s1 ASARKQYWKHIYKN-XGZKFQMDBZ Horiolide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,3,8-trihydroxy-6-methoxy-anthraquinone 1,3,8-trihydroxy-6-methoxyanthra-9,10-quinone 9,10-anthracenedione, 1,3,8-trihydroxy-6-methoxy- InChI=1/C15H10O6/c1-21-7-4-9-13(11(18)5-7)15(20)12-8(14(9)19)2-6(16)3-10(12)17/h2-5,16-18H,1H3 DGZZHABEBFUFSC-UHFFFAOYAT 1,3,8-trihydroxy-6-methoxy-anthraquinone Lunatin . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
[2-(4-Hydroxy-phenyl)-vinyl]-dithiocarbamic acid methyl ester methyl [(E)-2-(4-hydroxyphenyl)vinyl]dithiocarbamate carbamodithioic acid, [(E)-2-(4-hydroxyphenyl)ethenyl]-, methyl ester InChI=1/C10H11NOS2/c1-14-10(13)11-7-6-8-2-4-9(12)5-3-8/h2-7,12H,1H3,(H,11,13)/b7-6+ OPOPSTAOKBUQNZ-VOTSOKGWBE Tridentatol D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Hydroxy-1-(5-hydroxy-3-methyl-pentyl)-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalene-2-carboxylic acid rel-(2R,5R,10S)-2,19-dihydroxy-19-oxo-5,6,7,10,11,12,13,14-octahydro-5,10-cycloretinol 5,10-cycloretinol, 5,6,7,10,11,12,13,14-octahydro-2,19-dihydroxy-19-oxo-, (2R,5R,10S)- InChI=1/C20H34O4/c1-13(10-12-21)5-7-15-14(18(23)24)6-8-16-19(2,3)17(22)9-11-20(15,16)4/h6,13,15-17,21-22H,5,7-12H2,1-4H3,(H,23,24)/t13?,15-,16?,17-,20+/m1/s1 XEDCLIOKVSOTJJ-DHBPICGABB 3,15-Dihydroxy-ent-labd-7-en-17-oic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,6-Dihydroxy-5-methoxy-7-(3-methyl-buta-1,3-dienyl)-xanthen-9-one 1,6-dihydroxy-5-methoxy-7-[(1E)-3-methylbuta-1,3-dien-1-yl]-9H-xanthen-9-one 9H-xanthen-9-one, 1,6-dihydroxy-5-methoxy-7-[(1E)-3-methyl-1,3-butadienyl]- InChI=1/C19H16O5/c1-10(2)7-8-11-9-12-17(22)15-13(20)5-4-6-14(15)24-18(12)19(23-3)16(11)21/h4-9,20-21H,1H2,2-3H3/b8-7+ HWBGGUSOSGUXJQ-BQYQJAHWBT Globulixanthone A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(5aR,6R,7R,8R,10bS,12aR)-6,7-dihydroxy-7-(hydroxymethyl)-10b-methyl-4,5,6,7,8,9,10,10a,10b,11,12,12a-dodecahydro-5a,8-methanocyclohepta[5,6]naphtho[2,1-b]furan-2(3bH)-one 2,19-dioxa-10,27-diazapentacyclo[28.2.2.2~20,23~.1~3,7~.1~14,18~]octatriaconta-3,5,7(38),14,16,18(37),20,22,30,32,33,35-dodecaene-11,12,25,26-tetrone, 16,21,32-tribromo-4,17-dihydroxy-, 12,25-dioxime, InChI=1/C20H28O5/c1-18-6-5-14-12(8-16(22)25-14)13(18)4-7-19-9-11(2-3-15(18)19)20(24,10-21)17(19)23/h8,11,13-15,17,21,23-24H,2-7,9-10H2,1H3/t11?,13?,14-,15?,17-,18-,19-,20+/m1/s1 BHKIILDNBVMAHN-JFMFSJKFBA 4-nor-18-homo-ent-kauran-4(18)-en-15β,16β,17-triol-3β,19-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(4E,12Z,16R,16aS,17S,23aR)-9-glycoloyl-25-hydroxy-16a,21-dimethyl-6,7,10,11,16,16a,22,23-octahydro-3H,18H,19aH-spiro[5,9:16,18-dimethano[1,6,12]trioxacyclooctadecino[3,4-d]chromene-17,2'-oxirane]- InChI=1/C29H36O10/c1-17-6-9-27-15-35-24(33)12-18-7-10-36-28(25(18)34,19(31)14-30)8-4-3-5-23(32)39-20-13-22(38-21(27)11-17)29(16-37-29)26(20,27)2/h3,5,11-12,20-22,25,30,34H,4,6-10,13-16H2,1-2H3/b5-3-,18-12+/t20-,21?,22?,25?,26-,27-,28?,29+/m1/s1 NXTLPIJHYLFGEX-OETIAEISBR 14'-Hydroxymytoxin B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(12E,25E)-16,21,32-tribromo-4,17-dihydroxy-2,19-dioxa-10,27-diazapentacyclo[28.2.2.2~20,23~.1~3,7~.1~14,18~]octatriaconta-1(32),3(38),4,6,14(37),15,17,20,22,30,33,35-dodecaene-11,12,25,26-tetrone 12,2 2,19-dioxa-10,27-diazapentacyclo[28.2.2.2~20,23~.1~3,7~.1~14,18~]octatriaconta-3,5,7(38),14,16,18(37),20,22,30,32,33,35-dodecaene-11,12,25,26-tetrone, 16,21,32-tribromo-4,17-dihydroxy-, 12,25-dioxime, InChI=1/C34H29Br3N4O8/c35-22-11-18-2-5-28(22)48-30-16-19(1-4-27(30)42)8-10-39-34(45)26(41-47)15-21-13-24(37)32(43)31(17-21)49-29-6-3-20(12-23(29)36)14-25(40-46)33(44)38-9-7-18/h1-6,11-13,16-17,42-43,46-47H,7-10,14-15H2,(H,38,44)(H,39,45)/b40-25+,41-26+ TUYUXKVFCXANLL-QHTJZBTGBK Bastadin-21 . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 4-[6-hydroxy-3-methyl-6-(5-oxo-2,5-dihydro-furan-3-yl)-hex-3-enyl]-3,4,8a-trimethyl-8-methylene-decahydro-naphthalen-2-yl ester (2R,3R,4S,8aS)-4-[(3E,6R)-6-hydroxy-3-methyl-6-(5-oxo-2,5-dihydrofuran-3-yl)hex-3-en-1-yl]-3,4,8a-trimethyl-8-methylenedecahydronaphthalen-2-yl rel-acetate 2(5H)-furanone, 4-[(1R,3E)-6-[(1S,2R,3R,4aS)-3-(acetyloxy)decahydro-1,2,4a-trimethyl-5-methylene-1-naphthalenyl]-1-hydroxy-4-methyl-3-hexenyl]- InChI=1/C27H40O5/c1-17(10-11-22(29)21-14-25(30)31-16-21)12-13-26(5)19(3)23(32-20(4)28)15-27(6)18(2)8-7-9-24(26)27/h10,14,19,22-24,29H,2,7-9,11-13,15-16H2,1,3-6H3/b17-10+/t19-,22+,23+,24?,26+,27+/m0/s1 DHZHHHTYJVQJEJ-BPCXDRKXBZ Thorectandrol C . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-Isopropenyl-2-methylene-cyclohexyl-hydroperoxide (1R,5R)-5-isopropenyl-2-methylenecyclohexyl rel-hydroperoxide hydroperoxide, (1S,5S)-2-methylene-5-(1-methylethenyl)cyclohexyl InChI=1/C10H16O2/c1-7(2)9-5-4-8(3)10(6-9)12-11/h9-11H,1,3-6H2,2H3/t9-,10-/m0/s1 CSOZFPOODGAASP-UWVGGRQHBG (-)-(2S,4S)-p-Mentha-1(7),8-dien-2-hydroperoxide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
methyl rel-(3aR,4R,6S,6aR,7R,9bR)-3a,6-dihydroxy-7,9b-dimethyl-3,8-dioxo-1,3a,4,7,8,9b-hexahydro-3H-4,6a-methanocyclopenta[c]furo[3,4-e]oxepine-6-carboxylate 6H-4,6a-methano-3H-cyclopenta[c]furo[3,4-e]oxepin-6-carboxylic acid, 1,3a,4,7,8,9b-hexahydro-3a,6-dihydroxy-7,9b-dimethyl-3,8-dioxo-, methyl ester, (3aR,4R,6S,6aR,7R,9bR)- InChI=1/C16H18O8/c1-7-8(17)4-9-13(2)6-23-11(18)15(13,20)10-5-14(7,9)16(21,24-10)12(19)22-3/h4,7,10,20-21H,5-6H2,1-3H3/t7-,10+,13-,14+,15+,16?/m0/s1 RVLZTXZDKYFFMN-LRCVSGIZBN Jiadifenin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Methyl-5-(5,5,8a-trimethyl-2-methylene-decahydro-naphthalen-1-yl)-pent-1-en-3-ol rel-3-methyl-5-[(1R,8aS)-5,5,8a-trimethyl-2-methylenedecahydronaphthalen-1-yl]pent-1-en-3-ol 1-naphthalenepropanol, alpha-ethenyldecahydro-alpha,5,5,8a-tetramethyl-2-methylene-, (1R,8aS)- InChI=1/C20H34O/c1-7-19(5,21)14-11-16-15(2)9-10-17-18(3,4)12-8-13-20(16,17)6/h7,16-17,21H,1-2,8-14H2,3-6H3/t16-,17?,19?,20-/m1/s1 CECREIRZLPLYDM-OYGLOCFBBA Vitexifolin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-(12,15-Dihydroxy-4,4,10,13,14-pentamethyl-3,7,11-trioxo-2,3,4,5,6,7,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methyl-4-oxo-hept-5-enoic acid (5xi,12alpha,15beta,20Z)-12,15-dihydroxy-3,7,11,23-tetraoxolanosta-8,20(22)-dien-26-oic acid lanosta-8,20(22)-dien-26-oic acid, 12,15-dihydroxy-3,7,11,23-tetraoxo-, (5xi,12alpha,15beta,20Z)- InChI=1/C30H40O8/c1-14(10-16(31)11-15(2)26(37)38)17-12-21(34)30(7)22-18(32)13-19-27(3,4)20(33)8-9-28(19,5)23(22)24(35)25(36)29(17,30)6/h10,15,17,19,21,25,34,36H,8-9,11-13H2,1-7H3,(H,37,38)/b14-10-/t15?,17-,19?,21-,25+,28+,29+,30+/m1/s1 PEGUBVVGNSOOBD-IZOKWNAMBT Elfvingic acid A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
17-[5-(1-Hydroxy-2-methoxy-2-methyl-propyl)-2-methoxy-tetrahydro-furan-3-yl]-4,4,10,13,14-pentamethyl-1,2,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-cyclopenta[a]phenanthren-3-one rel-(10R,13S,14S,17S)-17-[(2R,3S)-5-(1-hydroxy-2-methoxy-2-methylpropyl)-2-methoxytetrahydrofuran-3-yl]-4,4,10,13,14-pentamethyl-1,2,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phen 9,19-cyclolanostan-28-oic acid, 3,7,16-trihydroxy-24-methylene-, (3beta,5xi,7beta,8xi,9xi,10xi,16beta,17xi,20xi)- InChI=1/C32H52O5/c1-28(2)24-11-10-22-21(30(24,5)15-14-25(28)33)13-17-31(6)20(12-16-32(22,31)7)19-18-23(37-27(19)35-8)26(34)29(3,4)36-9/h10,19-21,23-24,26-27,34H,11-18H2,1-9H3/t19-,20-,21?,23?,24?,26?,27+,30+,31-,32+/m0/s1 LEHCWPXGSDLCRO-BSUUDPCJBN 21α,25-Dimethylmelianodiol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
17-(1,5-Dimethyl-hex-4-enyl)-1,3,16-trihydroxy-4,13,14-trimethyl-tetradecahydro-cyclopropa[9,10]cyclopenta[a]phenanthrene-4-carboxylic acid (3beta,5xi,7beta,8xi,9xi,10xi,16beta,17xi,20xi)-3,7,16-trihydroxy-24-methylene-9,19-cyclolanostan-28-oic acid 9,19-cyclolanostan-28-oic acid, 3,7,16-trihydroxy-24-methylene-, (3beta,5xi,7beta,8xi,9xi,10xi,16beta,17xi,20xi)- InChI=1/C31H50O5/c1-17(2)18(3)8-9-19(4)24-21(33)15-28(6)25-20(32)14-22-29(7,26(35)36)23(34)10-11-30(22)16-31(25,30)13-12-27(24,28)5/h17,19-25,32-34H,3,8-16H2,1-2,4-7H3,(H,35,36)/t19?,20-,21-,22?,23-,24?,25?,27+,28-,29-,30?,31?/m0/s1 NMGCAUZQKXGUAO-HIPLDIHLBR 7β,16β-Dihydroxy-1,23-dideoxyjessic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
11-Methyl-12,13-dioxa-tricyclo[8.2.1.0^(2,7)]trideca-2(7),3,5,8-tetraen-3-ol rel-(1R,3R,4S)-3-methyl-3,4-dihydro-1H-1,4-epoxy-2-benzoxocin-10-ol 1,4-epoxy-1H-2-benzoxocin-10-ol, 3,4-dihydro-3-methyl-, (1R,3R,4S)- InChI=1/C12H12O3/c1-7-10-6-5-8-3-2-4-9(13)11(8)12(14-7)15-10/h2-7,10,12-13H,1H3/t7-,10+,12-/m1/s1 MQNPAODYALMZAI-INNHCVQGBZ Cladoacetal A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4,12,12-Trimethyl-9-methylene-5-oxa-tricyclo[8.2.0.0^(4,6)]dodecan-3-ol rel-(3R,4S)-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.0~4,6~]dodecan-3-ol 5-oxatricyclo[8.2.0.0~4,6~]dodecan-3-ol, 4,12,12-trimethyl-9-methylene-, (3S,4R)- InChI=1/C15H24O2/c1-9-5-6-13-15(4,17-13)12(16)7-11-10(9)8-14(11,2)3/h10-13,16H,1,5-8H2,2-4H3/t10?,11?,12-,13?,15+/m0/s1 FWFSLBQGEMBSLF-IZQYEQLFBY Suberosol A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Dec-8-ene-4,6-diyne-1,3-diol (8E)-dec-8-ene-4,6-diyne-1,3-diol 8-decene-4,6-diyne-1,3-diol, (3R,8E)- InChI=1/C10H12O2/c1-2-3-4-5-6-7-10(12)8-9-11/h2-3,10-12H,8-9H2,1H3/b3-2+/t10-/m0/s1 ZIRUVVYZSHKYCQ-PBKGFPTLBO Gymnasterkoreayne A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
8-[4-(3-Hydroxy-propenyl)-2,6-dimethoxy-phenoxy]-2,6-dimethyl-octa-1,6-dien-4-ol (6E)-8-{4-[(1E)-3-hydroxyprop-1-en-1-yl]-2,6-dimethoxyphenoxy}-2,6-dimethylocta-1,6-dien-4-ol 1,6-octadien-4-ol, 8-[4-[(1E)-3-hydroxy-1-propenyl]-2,6-dimethoxyphenoxy]-2,6-dimethyl-, (6E)- InChI=1/C21H30O5/c1-15(2)11-18(23)12-16(3)8-10-26-21-19(24-4)13-17(7-6-9-22)14-20(21)25-5/h6-8,13-14,18,22-23H,1,9-12H2,2-5H3/b7-6+,16-8+ PIRMSMJKOZAZOF-QICXOPSUBW Nelumol B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-4-({(3R,3'R,4S)-7-(acetyloxy)-4-[(2E,4E,6E)-deca-2,4,6-trienoyloxy]-6',7-dimethyl-6,8-dioxo-3',4,4',5',6,6',7,8-octahydrospiro[isochromene-3,2'-pyran]-3'-yl}oxy)-4-oxobutanoic acid butanedioic acid, mono[(3S,3'S,4R)-7-(acetyloxy)-3',4,4',5',6,6',7,8-octahydro-6',7-dimethyl-6,8-dioxo-4-[[(2E,4E,6E)-1-oxo-2,4,6-decatrienyl]oxy]spiro[3H-2-benzopyran-3,2'-[2H]pyran]-3'-yl] ester InChI=1/C31H36O12/c1-5-6-7-8-9-10-11-12-26(36)41-29-21-17-23(33)30(4,43-20(3)32)28(38)22(21)18-39-31(29)24(14-13-19(2)42-31)40-27(37)16-15-25(34)35/h7-12,17-19,24,29H,5-6,13-16H2,1-4H3,(H,34,35)/b8-7+,10-9+,12-11+/t19?,24-,29+,30?,31+/m0/s1 BNUGSCJDRYIKLJ-XEIMBRGGBW Decipinin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
17-(4-ethyl-1,5-dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol (3beta,8xi,9xi,10xi,13xi,14xi,17xi,24S)-stigmast-5-en-3-ol stigmast-5-en-3-ol, (3beta,8xi,9xi,10xi,13xi,14xi,17xi,24S)- InChI=1/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21+,23+,24?,25?,26?,27?,28?,29?/m1/s1 KZJWDPNRJALLNS-IDMGOKPUBO γ-sitosterol (24αFH)-stigmast-5-en-3β-ol Clionasterol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-methoxy-3,4-dihydro-2H-naphthalen-1-one 6-methoxy-3,4-dihydronaphthalen-1(2H)-one 1(2H)-naphthalenone, 3,4-dihydro-6-methoxy- InChI=1/C11H12O2/c1-13-9-5-6-10-8(7-9)3-2-4-11(10)12/h5-7H,2-4H2,1H3 MNALUTYMBUBKNX-UHFFFAOYAS 6-methoxy-1,2,3,4-tetrahydro-1-naphthalenone 6-methoxy-1-tetralone 6-methoxy-3,4-dihydro-2H-naphthalen-1-one 6-Methoxy-3,4-dihydro-2H-naphthalin-1-on . Information we have got: NMR spectra 13C, 13C, 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-butyliminomethyl-phenol 2-[(E)-(butylimino)methyl]phenol phenol, 2-[(E)-(butylimino)methyl]- InChI=1/C11H15NO/c1-2-3-8-12-9-10-6-4-5-7-11(10)13/h4-7,9,13H,2-3,8H2,1H3/b12-9+ GLBOKVQFOAWGML-FMIVXFBMBS N-Butylsalicylaldimine N-n-Butyl-salicylaldimin . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
{(1R,5S,6R,8S,8aR)-8-(acetyloxy)-5,6-dimethyl-5-[2-(5-oxo-2,5-dihydrofuran-3-yl)ethyl]octahydro-8aH-spiro[naphthalene-1,2'-oxiran]-8a-yl}methyl rel-acetate 2(5H)-furanone, 4-[2-[(1R,5S,6R,8S,8aR)-8-(acetyloxy)-8a-[(acetyloxy)methyl]octahydro-5,6-dimethylspiro[naphthalene-1(2H),2'-oxiran]-5-yl]ethyl]- InChI=1/C24H34O7/c1-15-10-20(31-17(3)26)24(14-29-16(2)25)19(6-5-8-23(24)13-30-23)22(15,4)9-7-18-11-21(27)28-12-18/h11,15,19-20H,5-10,12-14H2,1-4H3/t15-,19?,20+,22+,23+,24+/m1/s1 RNYBNBANBCQZON-QNJUYJPHBY Ajugarin-1 . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,4,5-trimethoxy-benzoic acid 7-hydroxy-8-methyl-3-[3-(3,4,5-trimethoxy-phenyl)-acryloyloxy]-8-aza-bicyclo[3.2.1]oct-6-yl ester (6R,7S)-7-hydroxy-8-methyl-3-{[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-8-azabicyclo[3.2.1]oct-6-yl rel-3,4,5-trimethoxybenzoate benzoic acid, 3,4,5-trimethoxy-, (6R,7S)-7-hydroxy-8-methyl-3-[[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-8-azabicyclo[3.2.1]oct-6-yl ester InChI=1/C30H37NO11/c1-31-19-14-18(41-25(32)9-8-16-10-21(35-2)28(39-6)22(11-16)36-3)15-20(31)27(26(19)33)42-30(34)17-12-23(37-4)29(40-7)24(13-17)38-5/h8-13,18-20,26-27,33H,14-15H2,1-7H3/b9-8+/t18?,19?,20?,26-,27+/m0/s1 KOHAOVSIVQWVAQ-VHIBYTGJBX 7β-Hydroxy-6β-(3,4,5-trimethoxybenzoyloxy)-3α-(E)-(3,4,5-trimethoxycinnamoyloxy)tropane Erythrorotundine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,2-Bis-(1H-indol-3-yl)-ethane-1,2-dione 1,2-di-1H-indol-3-ylethane-1,2-dione 1,2-ethanedione, 1,2-di-1H-indol-3-yl- InChI=1/C18H12N2O2/c21-17(13-9-19-15-7-3-1-5-11(13)15)18(22)14-10-20-16-8-4-2-6-12(14)16/h1-10,19-20H VOUJHLROTVTYMT-UHFFFAOYAS 1,2-Bis(1H-indol-3-yl)ethane-1,2-dione Di-indol-3-yl-ethanedione . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,2-Dihydroxy-9,10-dimethoxy-3,3-dimethyl-2,3,13,13a-tetrahydro-1H,7aH-pyrano[2,3-c;6,5-f']dichromen-7-one rel-(1R,2S)-1,2-dihydroxy-9,10-dimethoxy-3,3-dimethyl-2,3,13,13a-tetrahydro-1H-chromeno[3,4-b]pyrano[2,3-h]chromen-7(7aH)-one (non-preferred name) InChI=1/C23H24O8/c1-23(2)22(26)20(25)18-12(31-23)6-5-10-19(24)17-11-7-14(27-3)15(28-4)8-13(11)29-9-16(17)30-21(10)18/h5-8,16-17,20,22,25-26H,9H2,1-4H3/t16?,17?,20-,22+/m0/s1 KANDATZVPJBSEB-MPPJEYDWBH Derrisin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,6,10-Trimethyl-12-(3-methyl-furan-2-yl)-dodeca-2,6,10-trienoic acid (2Z,6E,10E)-2,6,10-trimethyl-12-(3-methyl-2-furyl)dodeca-2,6,10-trienoic acid 2,6,10-dodecatrienoic acid, 2,6,10-trimethyl-12-(3-methyl-2-furanyl)-, (2Z,6E,10E)- InChI=1/C20H28O3/c1-15(9-6-10-18(4)20(21)22)7-5-8-16(2)11-12-19-17(3)13-14-23-19/h7,10-11,13-14H,5-6,8-9,12H2,1-4H3,(H,21,22)/b15-7+,16-11+,18-10- BMGJSWCTAGIXJL-SBFKIVPVBD Saurufuran A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-(1H-Imidazol-4-ylmethyl)-2,3,4,9-tetrahydro-1H-β-carboline 1-(1H-imidazol-4-ylmethyl)-2,3,4,9-tetrahydro-1H-beta-carboline 1H-pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-1-(1H-imidazol-4-ylmethyl)- InChI=1/C15H16N4/c1-2-4-13-11(3-1)12-5-6-17-14(15(12)19-13)7-10-8-16-9-18-10/h1-4,8-9,14,17,19H,5-7H2,(H,16,18) SLFMYESZZPZJHF-UHFFFAOYAM Haploscleridamine . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-Methoxy-dodec-4-enoic acid [3-chloro-2-(2-hydroxy-2,3,5,5-tetramethyl-4,6-dioxo-cyclohexyl)-allyl]-amide rel-(4E,7R)-N-{(2E)-3-chloro-2-[(2S,3R)-2-hydroxy-2,3,5,5-tetramethyl-4,6-dioxocyclohexyl]prop-2-en-1-yl}-7-methoxydodec-4-enamide 4-dodecenamide, N-[(2E)-3-chloro-2-[(2R,3S)-2-hydroxy-2,3,5,5-tetramethyl-4,6-dioxocyclohexyl]-2-propenyl]-7-methoxy-, (4E,7S)- InChI=1/C26H42ClNO5/c1-7-8-10-13-20(33-6)14-11-9-12-15-21(29)28-17-19(16-27)22-24(31)25(3,4)23(30)18(2)26(22,5)32/h9,11,16,18,20,22,32H,7-8,10,12-15,17H2,1-6H3,(H,28,29)/b11-9+,19-16-/t18-,20+,22?,26-/m1/s1 YISCQTHSBLSJHQ-GSAWXPQFBB Malyngamide S . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Hydroxy-4-(7-hydroxy-8-methoxy-2-oxo-2H-chromen-3-yl)-2-methyl-but-3-enoic acid methyl ester methyl (3E)-2-hydroxy-4-(7-hydroxy-8-methoxy-2-oxo-2H-chromen-3-yl)-2-methylbut-3-enoate 3-butenoic acid, 2-hydroxy-4-(7-hydroxy-8-methoxy-2-oxo-2H-1-benzopyran-3-yl)-2-methyl-, methyl ester, (3E)- InChI=1/C16H16O7/c1-16(20,15(19)22-3)7-6-10-8-9-4-5-11(17)13(21-2)12(9)23-14(10)18/h4-8,17,20H,1-3H3/b7-6+ QMHAHKWRWQNBQI-VOTSOKGWBZ Phebaclavin H . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,6,8-Trihydroxy-3-methyl-benzo[α]anthracene-1,4,7,12-tetraone 2,6,8-trihydroxy-3-methyltetraphene-1,4,7,12-tetrone benz[a]anthracene-1,4,7,12-tetrone, 2,6,8-trihydroxy-3-methyl- InChI=1/C19H10O7/c1-6-15(22)8-5-10(21)13-14(12(8)19(26)16(6)23)17(24)7-3-2-4-9(20)11(7)18(13)25/h2-5,20-21,23H,1H3 LRVJUCBWMNTDLP-UHFFFAOYAH Oviedomycin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,8-Dihydroxy-3,3,11,11-tetramethyl-6-(3-methyl-but-2-enyl)-3H,11H-4,12,14-trioxa-benzo[a]naphthacen-7-one 5,8-dihydroxy-3,3,11,11-tetramethyl-6-(3-methylbut-2-en-1-yl)-3H,7H,11H-dipyrano[3,2-b:3',2'-h]xanthen-7-one 3H,7H,11H-dipyrano[3,2-b:3',2'-h]xanthen-7-one, 5,8-dihydroxy-3,3,11,11-tetramethyl-6-(3-methyl-2-butenyl)- InChI=1/C28H28O6/c1-14(2)7-8-16-20-24(31)21-19(13-18-15(22(21)29)9-11-27(3,4)33-18)32-25(20)17-10-12-28(5,6)34-26(17)23(16)30/h7,9-13,29-30H,8H2,1-6H3 YXCXOSIXGSUDDV-UHFFFAOYAX Mangostenone A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-allyl-2,4,5-trimethoxy-benzene 1-allyl-2,4,5-trimethoxybenzene benzene, 1,2,4-trimethoxy-5-(2-propenyl)- InChI=1/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5,7-8H,1,6H2,2-4H3 AUNAUZZQBAIQFJ-UHFFFAOYAF γ-Asarone 2,4,5-Trimethoxyallylbenzene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
8-Hydroxy-4-(4-hydroxy-4-methyl-pent-2-enylidene)-11-methylene-decahydro-cyclonona[c]pyran-3,7-dione (4Z)-8-hydroxy-4-[(2E)-4-hydroxy-4-methylpent-2-en-1-ylidene]-7,11-bis(methylene)decahydrocyclonona[c]pyran-3(1H)-one cyclonona[c]pyran-3(1H)-one, decahydro-8-hydroxy-4-[(2E)-4-hydroxy-4-methyl-2-pentenylidene]-7,11-bis(methylene)-, (4Z)- InChI=1/C20H28O4/c1-13-8-10-18(21)14(2)7-9-15-16(6-5-11-20(3,4)23)19(22)24-12-17(13)15/h5-6,11,15,17-18,21,23H,1-2,7-10,12H2,3-4H3/b11-5+,16-6- DKAXGACCDFMXHY-JTCYUCKDBR Xeniolide-F . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
dimethyl 5-(3-furyl)-2'-methyl-2-oxo-3',4,4',5-tetrahydro-2'H-spiro[furan-3,1'-naphthalene]-4a',5'(8a'H)-dicarboxylate spiro[furan-3(2H),1'(2'H)-naphthalene]-4'a,5'(8a'H)-dicarboxylic acid, 5-(3-furanyl)-3',4,4',5-tetrahydro-2'-methyl-2-oxo-, dimethyl ester, (3R)- InChI=1/C22H24O7/c1-13-7-9-21(19(24)27-3)15(18(23)26-2)5-4-6-17(21)22(13)11-16(29-20(22)25)14-8-10-28-12-14/h4-6,8,10,12-13,16-17H,7,9,11H2,1-3H3/t13?,16?,17?,21?,22-/m1/s1 XPPYVZZOGZYFJV-VDRBXWGCBZ 15,16-Epoxy-1,3,13(16),14-clerodatetraen-20,12-olide-18,19-dioic acid dimethylester Crotozambefuran A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(3,4-Dihydroxy-phenyl)-7-hydroxy-2,3-dihydro-benzofuran-4-carbaldehyde 2-(3,4-dihydroxyphenyl)-7-hydroxy-1-benzofuran-4-carbaldehyde 4-benzofurancarboxaldehyde, 2-(3,4-dihydroxyphenyl)-7-hydroxy- InChI=1/C15H10O5/c16-7-9-2-4-12(18)15-10(9)6-14(20-15)8-1-3-11(17)13(19)5-8/h1-7,17-19H XQXIDELHPWXTDD-UHFFFAOYAJ Tournefolal . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1H-Pyrrole-2-carboxylic acid 5-(2-methoxy-5-oxo-pyrrolidin-1-yl)-2,5-dihydro-furan-3-ylmethyl ester [5-(2-methoxy-5-oxopyrrolidin-1-yl)-2,5-dihydrofuran-3-yl]methyl 1H-pyrrole-2-carboxylate 1H-pyrrole-2-carboxylic acid, [(5S)-2,5-dihydro-5-(2-methoxy-5-oxo-1-pyrrolidinyl)-3-furanyl]methyl ester InChI=1/C15H18N2O5/c1-20-13-5-4-12(18)17(13)14-7-10(8-21-14)9-22-15(19)11-3-2-6-16-11/h2-3,6-7,13-14,16H,4-5,8-9H2,1H3/t13?,14-/m0/s1 BPMLAWBYBLOCCU-KBPBESRZBV Brachystemidine A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(6R,12aS,12bS,13R)-9-methoxy-5,6-dihydro-3H,4H-6,12b,12a-(propane[1,1,3]triyl)-3a,10b-diazabenzo[7,8]cycloocta[1,2,3-cd]inden-11-one 6,12b,12a-[1,1,3]propanetriyl-3H,4H-3a,10b-diazabenzo[7,8]cyclooct[1,2,3-cd]inden-11(12H)-one, 5,6-dihydro-9-methoxy-, (6R,12aS,12bS,13R)- InChI=1/C20H22N2O2/c1-24-13-3-4-15-14-6-10-21-9-2-7-19-8-5-16(14)20(19,21)22(17(15)11-13)18(23)12-19/h2-4,7,11,14,16H,5-6,8-10,12H2,1H3/t14-,16+,19-,20-/m0/s1 GHZIYRPRBMQWSP-UFANWAFLBT Isoschizogaline . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Isobutyric acid 1,13-dihydroxy-2,11-dimethyl-7-methylene-6-oxo-5,14-dioxa-tricyclo[9.2.1.0^(4,8)]tetradec-9-yl ester (3aR,4S,6R,8S,9S,10R,11aS)-8,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxododecahydro-6,9-epoxycyclodeca[b]furan-4-yl rel-2-methylpropanoate propanoic acid, 2-methyl-, (3aS,4R,6S,8R,9R,10S,11aR)-dodecahydro-8,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxo-6,9-epoxycyclodeca[b]furan-4-yl ester InChI=1/C19H28O7/c1-9(2)16(21)25-13-7-18(5)8-14(20)19(23,26-18)10(3)6-12-15(13)11(4)17(22)24-12/h9-10,12-15,20,23H,4,6-8H2,1-3,5H3/t10-,12+,13+,14+,15-,18+,19+/m0/s1 UFLGQPOBCWRADC-JWEFVCNNBH 2α-Hydroxytirotundin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3a,5,5,8-Tetramethyl-5a,6,7,8-tetrahydro-5H-cyclopenta[c]pentalene-3,4-dione rel-(3aR,8S)-3a,5,5,8-tetramethyl-5a,6,7,8-tetrahydrocyclopenta[c]pentalene-3,4(3aH,5H)-dione cyclopenta[c]pentalene-3,4(3aH,5H)-dione, 5a,6,7,8-tetrahydro-3a,5,5,8-tetramethyl-, (3aS,8R)- InChI=1/C15H20O2/c1-9-5-6-10-13(2,3)12(17)14(4)11(16)7-8-15(9,10)14/h7-10H,5-6H2,1-4H3/t9-,10?,14+,15?/m1/s1 YQHSMMDPMZHSTH-AYBBVMILBB Silphinen-3,5-dione . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,7-Dibromo-8-chloro-6-hydroxy-3,7-dimethyl-oct-3-en-2-one rel-(3E,6R,7S)-1,7-dibromo-8-chloro-6-hydroxy-3,7-dimethyloct-3-en-2-one 3-octen-2-one, 1,7-dibromo-8-chloro-6-hydroxy-3,7-dimethyl-, (3E,6R,7S)- InChI=1/C10H15Br2ClO2/c1-7(8(14)5-11)3-4-9(15)10(2,12)6-13/h3,9,15H,4-6H2,1-2H3/b7-3+/t9-,10-/m1/s1 JFBIONWRLPBEBH-ZCZHLORFBM Plocamenol C . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(10R,11S)-3-acetyl-11-ethyl-7-oxo-3,4,5,10,11,11a,12,12a-octahydro-7H-imidazo[4,5-a]pyrano[3,4-g]quinolizin-10-yl rel-2,3,4,6-tetra-O-acetylhexopyranoside 7H-imidazo[4,5-a]pyrano[3,4-g]quinolizin-7-one, 3-acetyl-11-ethyl-3,4,5,10,11,11a,12,12a-octahydro-10-[(2,3,4,6-tetra-O-acetylhexopyranosyl)oxy]-, (10S,11R)- InChI=1/C31H39N3O13/c1-7-19-20-10-23-25-22(34(13-32-25)14(2)35)8-9-33(23)29(40)21(20)11-42-30(19)47-31-28(45-18(6)39)27(44-17(5)38)26(43-16(4)37)24(46-31)12-41-15(3)36/h11,13,19-20,23-24,26-28,30-31H,7-10,12H2,1-6H3/t19-,20?,23?,24?,26?,27?,28?,30+,31?/m LLLDDBHHGYHECI-YOTLSQJZBD O',O',O',O'-Pentaacetyl-14,15-dihydrohistelosamide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(3aR,4aS,6aS,9aS)-1,4a-dimethyl-7-methylene-5,6,6a,7,9a,9b-hexahydro-3H-oxireno[8,8a]azuleno[4,5-b]furan-8(4aH)-one 3H-oxireno[8,8a]azuleno[4,5-b]furan-8(4aH)-one, 5,6,6a,7,9a,9b-hexahydro-1,4a-dimethyl-7-methylene-, (3aR,4aS,6aS,9aS)- InChI=1/C15H18O3/c1-8-4-7-15-11(8)12-10(9(2)13(16)17-12)5-6-14(15,3)18-15/h4,10-12H,2,5-7H2,1,3H3/t10-,11?,12-,14-,15+/m0/s1 UVJYAKBJSGRTHA-FWPZYLILBM Arglabin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Bromo-1,3,4,5-tetrahydro-pyrrolo[4,3,2-de]quinoline-7,8-dione 6-bromo-1,3,4,5-tetrahydropyrrolo[4,3,2-de]quinoline-7,8-dione pyrrolo[4,3,2-de]quinoline-7,8-dione, 6-bromo-1,3,4,5-tetrahydro- InChI=1/C10H7BrN2O2/c11-6-7-5-4(1-2-12-7)3-13-8(5)10(15)9(6)14/h3,12-13H,1-2H2 FDGKQWLSJXEOPF-UHFFFAOYAG Makaluvamine O . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(3aR,7R,8R,9S,9bS)-6,9-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,7,8,9,9a,9b-decahydro-7,9-epoxyazuleno[4,5-b]furan-8-yl rel-2-methylbutanoate butanoic acid, 2-methyl-, (3aS,7S,8S,9R,9bR)-2,3,3a,4,5,7,8,9,9a,9b-decahydro-6,9-dimethyl-3-methylene-2-oxo-7,9-epoxyazuleno[4,5-b]furan-8-yl ester InChI=1/C20H26O5/c1-6-9(2)18(21)24-17-16-13-10(3)7-8-12-11(4)19(22)23-15(12)14(13)20(17,5)25-16/h9,12,14-17H,4,6-8H2,1-3,5H3/t9?,12-,14?,15+,16-,17-,20+/m0/s1 FPLUWNGZVAMKNR-BCOMRIBRBY 5αH-2β,4-Epoxy-3β-(2-methylbutyryloxy)guaia-1(10),-11(13)-dien-6β,12-olide (3β-O-(2-methylbutyryl)moroccolide A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1alpha,5xi,9xi,10xi,13xi,14alpha,16beta,17xi)-20-ethyl-4-(hydroxymethyl)-8,16-dimethoxyaconitane-1,14-diol aconitane-1,14-diol, 20-ethyl-4-(hydroxymethyl)-8,16-dimethoxy-, (1alpha,5xi,9xi,10xi,13xi,14alpha,16beta,17xi)- InChI=1/C23H37NO5/c1-4-24-10-21(11-25)6-5-17(26)23-13-7-12-15(28-2)9-22(29-3,18(13)19(12)27)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12?,13?,14?,15-,16?,17-,18?,19-,20?,21-,22-,23?/m0/s1 HOCJNIVJUMYCKR-LRUGNSDMBC 8-O-methylcolumbianine Raveyine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1aR,7R,7aS,7bR)-1,1,4,7-tetramethyl-1a,2,6,7,7a,7b-hexahydro-1H-cyclopropa[e]azulene 1H-cycloprop[e]azulene, 1a,2,6,7,7a,7b-hexahydro-1,1,4,7-tetramethyl-, (1aR,7R,7aS,7bR)- InChI=1/C15H22/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h6-7,10,12-14H,5,8H2,1-4H3/t10-,12-,13-,14-/m1/s1 XIRNDKAPRNNOGW-FMKGYKFTBH aromadendra-1,9-diene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1R,1aR,4R,4aR,7R,7aR,7bS)-1-(hydroxymethyl)-1,4,7-trimethyldecahydro-3H-cyclopropa[e]azulen-3-one 3H-cycloprop[e]azulen-3-one, decahydro-1-(hydroxymethyl)-1,4,7-trimethyl-, (1R,1aR,4R,4aR,7R,7aR,7bS)- InChI=1/C15H24O2/c1-8-4-5-10-9(2)12(17)6-11-14(13(8)10)15(11,3)7-16/h8-11,13-14,16H,4-7H2,1-3H3/t8-,9-,10+,11-,13-,14-,15-/m1/s1 MAVWRBGZLAYXIE-UQJMEKPABG (1R,10R)-13-hydroxyaromadendr-9-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7,9-Dibromo-10-hydroxy-8-methoxy-1-oxa-2-aza-spiro[4.5]deca-2,6,8-triene-3-carboxylic acid (4-guanidino-2-hydroxy-butyl)-amide rel-(5R,10S)-N-(4-{[amino(imino)methyl]amino}-2-hydroxybutyl)-7,9-dibromo-10-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide 1-oxa-2-azaspiro[4.5]deca-2,6,8-triene-3-carboxamide, N-[4-[(aminoiminomethyl)amino]-2-hydroxybutyl]-7,9-dibromo-10-hydroxy-8-methoxy-, (5R,10S)- InChI=1/C15H21Br2N5O5/c1-26-11-8(16)4-15(12(24)10(11)17)5-9(22-27-15)13(25)21-6-7(23)2-3-20-14(18)19/h4,7,12,23-24H,2-3,5-6H2,1H3,(H,21,25)(H4,18,19,20)/t7?,12-,15+/m1/s1 RXBVKUAAUFHYBW-APWBMBHSBH Caissarine A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(3-Methoxy-phenyl)-furo[2,3-h]chromen-4-one 2-(3-methoxyphenyl)-4H-furo[2,3-h]chromen-4-one 4H-furo[2,3-h]-1-benzopyran-4-one, 2-(3-methoxyphenyl)- InChI=1/C18H12O4/c1-20-12-4-2-3-11(9-12)17-10-15(19)13-5-6-16-14(7-8-21-16)18(13)22-17/h2-10H,1H3 OHKLPDQPGIVELF-UHFFFAOYAP Pongol methyl ether . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,8-Dihydroxy-5,8-dimethyl-3-methylene-decahydro-azuleno[6,5-b]furan-2-one rel-(3aR,5R,8R,9aS)-5,8-dihydroxy-5,8-dimethyl-3-methylenedecahydroazuleno[6,5-b]furan-2(3H)-one azuleno[6,5-b]furan-2(3H)-one, decahydro-5,8-dihydroxy-5,8-dimethyl-3-methylene-, (3aR,5R,8R,9aS)- InChI=1/C15H22O4/c1-8-9-6-11-10(4-5-14(11,2)17)15(3,18)7-12(9)19-13(8)16/h9-12,17-18H,1,4-7H2,2-3H3/t9-,10?,11?,12+,14-,15-/m1/s1 WSMKPZGGGQUUQW-SRKMMUQKBF 4α,10α-Dihydroxy-1β(H),5β(H)-guai-11(13)-en-8α,12-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
methyl (5xi,8alpha,10alpha,12beta,13alpha)-16-hydroxy-12,17-epoxykaur-9(11)-en-18-oate stigmastan-15-one, 3,6,7,28-tetrahydroxy-, (3beta,6alpha,7beta,8xi,9xi,14xi,24xi)- InChI=1/C21H30O4/c1-18-6-4-7-19(2,17(22)24-3)15(18)5-8-20-10-13-14(9-16(18)20)25-12-21(13,23)11-20/h9,13-15,23H,4-8,10-12H2,1-3H3/t13?,14-,15?,18-,19-,20+,21+/m1/s1 YRLLCHPGMOPSAC-WYUCNNFVBO Ceriopsin E Methyl ent-12,17-epoxy-16β-hydroxy-9(11)-kauren-19-oate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,6,7-Trihydroxy-17-[4-(1-hydroxy-ethyl)-1,5-dimethyl-hexyl]-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-15-one (3beta,6alpha,7beta,8xi,9xi,14xi,24xi)-3,6,7,28-tetrahydroxystigmastan-15-one InChI=1/C29H50O5/c1-15(2)19(17(4)30)8-7-16(3)21-14-23(32)25-24-20(10-12-29(21,25)6)28(5)11-9-18(31)13-22(28)26(33)27(24)34/h15-22,24-27,30-31,33-34H,7-14H2,1-6H3/t16-,17?,18+,19?,20?,21-,22?,24?,25?,26-,27-,28-,29-/m1/s1 LRBORSRGSBLHKA-KDPFERTPBG Clathriol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl pentopyranosyl-(1->3)-6-deoxyhexopyranosyl-(1->6)hexopyranoside 4H-1-benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[[O-pentopyranosyl-(1->3)-O--6-deoxyhexopyranosyl-(1->6)hexopyranosyl]oxy]- InChI=1/C32H38O19/c1-10-19(37)28(50-30-24(42)20(38)15(36)8-45-30)26(44)31(47-10)46-9-17-21(39)23(41)25(43)32(49-17)51-29-22(40)18-14(35)6-13(34)7-16(18)48-27(29)11-2-4-12(33)5-3-11/h2-7,10,15,17,19-21,23-26,28,30-39,41-44H,8-9H2,1H3 PHKFQMUSOLODBO-UHFFFAOYAF Kaempferol-3-O-[β-D-xylopyranosyl(1->3)-α-L-rhamnopyranosyl(1->6)]-β-D-galactopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,10-Dihydroxy-7-methoxy-3-methyl-3-(4-methyl-pent-3-enyl)-3H-benzo[f]chromene-9-carboxylic acid methyl ester methyl 5,10-dihydroxy-7-methoxy-3-methyl-3-(4-methylpent-3-en-1-yl)-3H-benzo[f]chromene-9-carboxylate 3H-naphtho[2,1-b]pyran-9-carboxylic acid, 5,10-dihydroxy-7-methoxy-3-methyl-3-(4-methyl-3-pentenyl)-, methyl ester InChI=1/C23H26O6/c1-13(2)7-6-9-23(3)10-8-14-19-15(11-17(24)21(14)29-23)18(27-4)12-16(20(19)25)22(26)28-5/h7-8,10-12,24-25H,6,9H2,1-5H3 KOZKSXRTQNRWGJ-UHFFFAOYAY Methyl-5,10-dihydroxy-7-methoxy-3-methyl-3-[4-methyl-3-pentenyl]-3H-benzo[f]chromene-9-carboxylate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-Amino-6-chloro-1-methyl-1H-pyrrolo[4,3,2-de]quinolin-8-one 7-amino-6-chloro-1-methylpyrrolo[4,3,2-de]quinolin-8(1H)-one pyrrolo[4,3,2-de]quinolin-8(1H)-one, 7-amino-6-chloro-1-methyl- InChI=1/C11H8ClN3O/c1-15-4-5-2-3-14-9-6(5)10(15)11(16)8(13)7(9)12/h2-4H,13H2,1H3 PQYDUSMCHWLZPN-UHFFFAOYAY Isobatzelline E . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
11-[5-(3-Carboxy-butyrylcarbamoyl)-4-oxo-4H-pyran-2-yl]-undeca-8,10-dienoic acid (8E,10E)-11-(5-{[(3-carboxybutanoyl)amino]carbonyl}-4-oxo-4H-pyran-2-yl)undeca-8,10-dienoic acid 8,10-undecadienoic acid, 11-[5-[[[(3S)-3-carboxy-1-oxobutyl]amino]carbonyl]-4-oxo-4H-pyran-2-yl]-, (8E,10E)- InChI=1/C22H27NO8/c1-15(22(29)30)12-19(25)23-21(28)17-14-31-16(13-18(17)24)10-8-6-4-2-3-5-7-9-11-20(26)27/h4,6,8,10,13-15H,2-3,5,7,9,11-12H2,1H3,(H,26,27)(H,29,30)(H,23,25,28)/b6-4+,10-8+/t15-/m0/s1 VXFQAPGOPXEMPB-ZDHJVBDKBH Microsphaerone A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Hydroxy-2,2,3b,4-tetramethyl-3,3b,4,6,6a,7-hexahydro-2H-cyclopenta[a]pentalene-1,5-dione rel-(3R,3bS,4R)-3-hydroxy-2,2,3b,4-tetramethyl-3,3b,4,6,6a,7-hexahydro-1H-cyclopenta[a]pentalene-1,5(2H)-dione 1H-cyclopenta[a]pentalene-1,5(2H)-dione, 3,3b,4,6,6a,7-hexahydro-3-hydroxy-2,2,3b,4-tetramethyl-, (3R,3bS,4R)- InChI=1/C15H20O3/c1-7-10(16)6-8-5-9-11(15(7,8)4)13(18)14(2,3)12(9)17/h7-8,13,18H,5-6H2,1-4H3/t7-,8?,13+,15+/m0/s1 JDNHHSVZZOCUOM-UQDLMBBGBM Hirsutenol A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,3,6-tribromo-1-methyl-1H-indole 2,3,6-tribromo-1-methyl-1H-indole 1H-indole, 2,3,6-tribromo-1-methyl- InChI=1/C9H6Br3N/c1-13-7-4-5(10)2-3-6(7)8(11)9(13)12/h2-4H,1H3 VNXWBQUYRZQEEF-UHFFFAOYAY 2,3,6-tribromo-1-methyl-indole . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Hydroxymethyl-5-methoxy-6-(7-methoxy-3,7-dimethyl-octa-2,5-dienyl)-2-methoxymethyl-phenol 3-(hydroxymethyl)-5-methoxy-6-[(2E,5E)-7-methoxy-3,7-dimethylocta-2,5-dien-1-yl]-2-(methoxymethyl)phenol benzenemethanol, 3-hydroxy-5-methoxy-4-[(2E,5E)-7-methoxy-3,7-dimethyl-2,5-octadienyl]-2-(methoxymethyl)- InChI=1/C21H32O5/c1-15(8-7-11-21(2,3)26-6)9-10-17-19(25-5)12-16(13-22)18(14-24-4)20(17)23/h7,9,11-12,22-23H,8,10,13-14H2,1-6H3/b11-7+,15-9+ ZDQPYKPEXKAJMI-BIUQSXLLBY 1-hydroxy-5-hydroxymethyl-6-methoxymethyl-3-methoxy-2-(7-methoxy-3,7-dimethylocta-2,6-dienyl)-benzene Hericenol D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(2,4-dihydroxy-phenyl)-5,7-dihydroxy-8-(2-isopropenyl-5-methyl-hex-4-enyl)-chroman-4-one 2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(2-isopropenyl-5-methylhex-4-en-1-yl)-2,3-dihydro-4H-chromen-4-one 4H-1-benzopyran-4-one, 2-(2,4-dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-8-[5-methyl-2-(1-methylethenyl)-4-hexenyl]-, (2S)- InChI=1/C25H28O6/c1-13(2)5-6-15(14(3)4)9-18-20(28)11-21(29)24-22(30)12-23(31-25(18)24)17-8-7-16(26)10-19(17)27/h5,7-8,10-11,15,23,26-29H,3,6,9,12H2,1-2,4H3/t15?,23-/m0/s1 XRYVAQQLDYTHCL-GMTBNIFVBX Sophoraflavanone G . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(5xi,6beta,11alpha,13alpha)-6,9,11-trihydroxy-6,20-epoxypimara-8(14),15-diene-7,20-dione 9H-10,4a-(epoxymethano)phenanthrene-9,12-dione, 7-ethenyl-1,2,3,4,4b,5,6,7,10,10a-decahydro-4b,5,10-trihydroxy-1,1,7-trimethyl-, (4aR,4bR,5R,7R,10S)- InChI=1/C20H26O6/c1-5-17(4)9-11-13(22)20(25)14-16(2,3)7-6-8-18(14,15(23)26-20)19(11,24)12(21)10-17/h5,9,12,14,21,24-25H,1,6-8,10H2,2-4H3/t12-,14?,17-,18+,19+,20-/m1/s1 RGMZNUAVQHIGNL-DSFYQTMIBQ 9α,11α-dihydroxy-7-oxopimara-8(14),15-dien-20-oic acid 6,20-lactone Sphaeropsidin D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-[3-(3,7-Dimethyl-octa-2,6-dienyl)-4,5-dihydroxy-phenyl]-1-[3-(3,7-dimethyl-octa-2,6-dienyl)-2,4-dihydroxy-phenyl]-propenone (2E)-1-{3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-2,4-dihydroxyphenyl}-3-{3-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-4,5-dihydroxyphenyl}prop-2-en-1-one 2-propen-1-one, 1-[3-[(2E)-3,7-dimethyl-2,6-octadienyl]-2,4-dihydroxyphenyl]-3-[3-[(2E)-3,7-dimethyl-2,6-octadienyl]-4,5-dihydroxyphenyl]-, (2E)- InChI=1/C35H44O5/c1-23(2)9-7-11-25(5)13-16-28-21-27(22-33(38)34(28)39)15-19-31(36)30-18-20-32(37)29(35(30)40)17-14-26(6)12-8-10-24(3)4/h9-10,13-15,18-22,37-40H,7-8,11-12,16-17H2,1-6H3/b19-15+,25-13+,26-14+ AMMAXRCDDGJGFY-VQHLIIBVBB 5,3'-(3,7-dimethyl-2,6-octadienyl)-3,4,2',4'-tetrahydroxychalcone 5,3'-Digeranyl-3,4,2',4'-tetrahydroxychalcone Prorepensin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,7-Dihydroxy-2-{4-[2-hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-1-hydroxymethyl-ethoxy]-3,5-dimethoxy-phenyl}-chromen-4-one 5,7-dihydroxy-2-{4-[2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethoxy]-3,5-dimethoxyphenyl}-4H-chromen-4-one 4H-1-benzopyran-4-one, 5,7-dihydroxy-2-[4-[2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethoxy]-3,5-dimethoxyphenyl]- InChI=1/C27H26O11/c1-34-20-6-13(4-5-16(20)30)26(33)24(12-28)38-27-22(35-2)7-14(8-23(27)36-3)19-11-18(32)25-17(31)9-15(29)10-21(25)37-19/h4-11,24,26,28-31,33H,12H2,1-3H3 WXNJNHFYIWEHIL-UHFFFAOYAN Tricin-4'-0-(erythro-β-guaiacylglyceryl) ether . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(6a-Hydroxy-9-methoxy-6a,11a-dihydro-6H-benzo[4,5]furo[3,2-c]chromen-3-yloxy)-6-hydroxymethyl-tetrahydro-pyran-3,4,5-triol 6a-hydroxy-9-methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-yl hexopyranoside hexopyranoside, (6aS)-6a,11a-dihydro-6a-hydroxy-9-methoxy-6H-benzofuro[3,2-c][1]benzopyran-3-yl InChI=1/C22H24O10/c1-28-10-3-5-13-15(6-10)31-20-12-4-2-11(7-14(12)29-9-22(13,20)27)30-21-19(26)18(25)17(24)16(8-23)32-21/h2-7,16-21,23-27H,8-9H2,1H3/t16?,17?,18?,19?,20?,21?,22-/m1/s1 XGOMWYMWTMHUAG-CPGVEKMWBL (6a-S,11a-S)-3-O-β-D-glucopyranosyl-6a-hydroxy-9-methoxypterocarpan Licoagroside E . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
30-Hydroxy-dotriacont-28-ene-2,9,14,19,21,31-hexaynoic acid (28E)-30-hydroxydotriacont-28-ene-2,9,14,19,21,31-hexaynoic acid 28-dotriacontene-2,9,14,19,21,31-hexaynoic acid, 30-hydroxy-, (28E,30S)- InChI=1/C32H38O3/c1-2-31(33)29-27-25-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32(34)35/h1,27,29,31,33H,3,5,7-8,10,12,17-26H2,(H,34,35)/b29-27+/t31-/m1/s1 DDVIOADGWIMPIO-ISGQOPDGBF Callyspongynic Acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,7-Dihydroxy-13-(4-hydroxy-3,5-dimethoxy-6-methyl-tetrahydro-pyran-2-yloxy)-5,8-dimethyl-5-octa-3,5-dienyl-4,15-dioxa-bicyclo[9.3.1]pentadecan-3-one (1R,5S,7R,8S)-1,7-dihydroxy-5,8-dimethyl-5-[(3E,5E)-octa-3,5-dien-1-yl]-3-oxo-4,15-dioxabicyclo[9.3.1]pentadec-13-yl rel-6-deoxy-2,4-di-O-methyl-alpha-D-mannopyranoside 4,15-dioxabicyclo[9.3.1]pentadecan-3-one, 13-[(6-deoxy-2,4-di-O-methyl-alpha-L-mannopyranosyl)oxy]-1,7-dihydroxy-5,8-dimethyl-5-[(3E,5E)-3,5-octadienyl]-, (1S,5R,7S,8R)- InChI=1/C31H52O10/c1-7-8-9-10-11-12-15-30(4)18-24(32)20(2)13-14-22-16-23(17-31(35,40-22)19-25(33)41-30)39-29-28(37-6)26(34)27(36-5)21(3)38-29/h8-11,20-24,26-29,32,34-35H,7,12-19H2,1-6H3/b9-8+,11-10+/t20-,21+,22?,23?,24+,26-,27+,28-,29+,30-,31+/m1/s1 YYWHCGARYFKWST-KFFAGPNPBX Lyngbouilloside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(3alpha,5xi,8alpha,9xi,10alpha,14alpha)-8,14-dihydroxy-12,16-epoxy-3,18-cycloabiet-13(15)-en-16-one 6H-cyclopropa[7,8]phenanthro[3,2-b]furan-6-one, 1,1a,1b,2,3,3a,4,7a,8,8a,8b,9,10,10a-tetradecahydro-3a,4-dihydroxy-1a,5,8b-trimethyl-, (1aS,3aR,4S,8bR,10aR)- InChI=1/C20H28O4/c1-10-15-12(24-17(10)22)8-14-18(2)6-4-11-9-19(11,3)13(18)5-7-20(14,23)16(15)21/h11-14,16,21,23H,4-9H2,1-3H3/t11-,12?,13?,14?,16+,18-,19+,20-/m1/s1 ZZRMOWIKHWOSFN-UXDKBPQCBI Suregadolide A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Isobutyric acid 6-hydroxy-8-aza-bicyclo[3.2.1]oct-3-yl ester (3R,6R)-6-hydroxy-8-azabicyclo[3.2.1]oct-3-yl rel-2-methylpropanoate propanoic acid, 2-methyl-, (3R,6R)-6-hydroxy-8-azabicyclo[3.2.1]oct-3-yl ester InChI=1/C11H19NO3/c1-6(2)11(14)15-8-3-7-4-10(13)9(5-8)12-7/h6-10,12-13H,3-5H2,1-2H3/t7?,8-,9?,10-/m1/s1 UXCYARTWSGEQOP-QLVNRRSVBG 3α-Isobutyryloxy-7β-hydroxynortropane . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(6R,14R,16R,20R,22R)-14-cyano-6',8-dihydroxy-7',9-dimethoxy-4,10,23-trimethyl-22-oxido-19-oxo-3',4',6,7,12,13,14,16-octahydro-2'H,6aH-spiro[7,13-epimino-6,16-(epithiopropanooxymethano)[1,3]dioxolo[7,8 7H-phenaleno[1,2-d][1,3]dioxol-7-ol, 7a,10a-dihydro-1-(4-methoxyphenyl)-9,9-dimethyl-, (7R,7aS,10aR)- InChI=1/C40H42N4O11S/c1-17-9-21-10-23-24(13-41)44-25-14-52-39(48)40(22-12-27(50-5)26(46)11-20(22)7-8-42-40)15-56(49)38(32(44)31(43(23)4)28(21)33(47)34(17)51-6)30-29(25)37-36(53-16-54-37)18(2)35(30)55-19(3)45/h9,11-12,23-25,31-32,38,42,46-47H,7-8,10,14-16 RRCYSJADSSZEAZ-RIRMDFHJBE Ecteinascidin 786 . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(7R,7aS,10aR)-1-(4-methoxyphenyl)-9,9-dimethyl-7a,10a-dihydro-7H-phenaleno[1,2-d][1,3]dioxol-7-ol 7H-phenaleno[1,2-d][1,3]dioxol-7-ol, 7a,10a-dihydro-1-(4-methoxyphenyl)-9,9-dimethyl-, (7R,7aS,10aR)- InChI=1/C23H22O4/c1-23(2)26-21-19-16(13-7-10-15(25-3)11-8-13)12-9-14-5-4-6-17(18(14)19)20(24)22(21)27-23/h4-12,20-22,24H,1-3H3/t20-,21-,22+/m1/s1 JDSHDCBKXUPPKT-VSKRKVRLBA 1-(4-Methoxy-phenyl)-9,9-dimethyl-7a,10a-dihydro-7H-8,10-dioxa-cyclopenta[a]phenalen-7-ol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(2Z,6Z,11Z,17E)-5,9,10,14-tetraethyl-4,15-dimethyl-26,27,28-triazahexacyclo[16.6.1.1~3,6~.1~8,11~.1~13,16~.0~19,24~]octacosa-1(25),2,4,6,8(27),9,11,13,15,17,19,21,23-tridecaene-21-carbaldehyde (non-pr 1H-naphtho[2,1,8-mna]xanthen-1-one, 5-methoxy- InChI=1/C36H37N3O/c1-7-25-20(5)31-15-23-14-24(30-13-22(19-40)11-12-29(23)30)16-32-21(6)26(8-2)34(38-32)18-36-28(10-4)27(9-3)35(39-36)17-33(25)37-31/h11-19,37-38H,7-10H2,1-6H3/b23-15+,24-16+,31-15-,32-16-,33-17-,34-18-,35-17-,36-18- YMLGHSRUTHAJJY-YBFZGXQRBU triaza[18]annulenes . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
15-(3-Guanidino-propyl)-5,8-diisobutyl-18-(6-methoxy-3,5-dimethyl-7-phenyl-hepta-1,3-dienyl) -1,2,12,19-tetramethyl-3,6,9,13,16,20,25-heptaoxo-1,4,7,10,14,17,21heptaaza -cyclopentacosane-11,22-dicarboxylic acid rel-(5R,8S,11R,12S,15S,18S,19S,22R)-15-(3-{[amino(imino)methyl]amino}propyl)-5,8-diisobutyl-18-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl]-1,12,19-trimethyl-2-methylene-3,6,9,13 InChI=1/C52H80N10O12/c1-28(2)24-39-48(68)60-40(25-29(3)4)49(69)61-43(51(72)73)33(8)45(65)57-37(18-15-23-55-52(53)54)47(67)56-36(20-19-30(5)26-31(6)41(74-11)27-35-16-13-12-14-17-35)32(7)44(64)58-38(50(70)71)21-22-42(63)62(10)34(9)46(66)59-39/h12-14,16-17, PYRKYAINAPVHFV-OGPAHFFABQ [D-Leu^(1)]-microcystin-LR . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-methoxy-1H-naphtho[2,1,8-mna]xanthen-1-one 1H-naphtho[2,1,8-mna]xanthen-1-one, 5-methoxy- InChI=1/C20H12O3/c1-22-17-10-11-6-9-15(21)14-8-7-13-12-4-2-3-5-16(12)23-20(17)19(13)18(11)14/h2-10H,1H3 QSJJNMPYBULILS-UHFFFAOYAE 5-Methoxy-6-oxa-benzo[def]chrysen-1-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1aR,3S,4R,4aR,8aR,9aS)-8a-hydroxy-4,4a,6-trimethyl-7-oxo-2,3,4,4a,5,7,8a,9-octahydro-1aH-oxireno[8,8a]naphtho[2,3-b]furan-3-yl rel-3-methylbut-2-enoate 2-butenoic acid, 3-methyl-, (1aR,3S,4R,4aR,8aR,9aS)-1a,2,4,4a,5,7,8a,9-octahydro-8a-hydroxy-4,4a,6-trimethyl-7-oxo-3H-oxireno[8,8a]naphtho[2,3-b]furan-3-yl ester InChI=1/C20H26O6/c1-10(2)6-16(21)24-14-7-15-19(25-15)9-20(23)13(11(3)17(22)26-20)8-18(19,5)12(14)4/h6,12,14-15,23H,7-9H2,1-5H3/t12-,14-,15+,18+,19+,20+/m0/s1 WPFQQVQRNHAKQJ-AUZPMGFGBE 3β-Senecioyloxy-1β,10β-epoxy-8α-hydroxyeremophil-7(11)-en-8β(12)-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1'R,2S,4aR,5'R,5aR,7R,7aR,7bR,8R,10S,11aS,12aS)-1,1,5',7a,8,12a-hexamethyl-2-{[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl]oxy}hexadecahydro-2H-spiro[cyclopropa[1',8a']naphtho[2',1':4,5]in beta-D-xylopyranoside, (2S,4aR,5'R,5aR,7R,7aR,7bR,10S,11aS,12aS)-7-(acetyloxy)hexadecahydro-1,1,5',7a,8,12a-hexamethylspiro[5H-cyclopropa[1',8'a]naphth[2',1':4,5]indeno[2,1-b]pyran-10(2H),2'-[3,6]diox InChI=1/C37H56O10/c1-18-12-37(30-33(6,47-30)17-43-37)46-21-13-32(5)23-9-8-22-31(3,4)24(45-29-28(41)27(40)20(39)15-42-29)10-11-35(22)16-36(23,35)14-25(44-19(2)38)34(32,7)26(18)21/h18,20-30,39-41H,8-17H2,1-7H3/t18-,20-,21+,22?,23?,24+,25-,26+,27+,28-,29+,3 GCMGJWLOGKSUGX-LCMIBCKCBF 26-Deoxyactein . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6,8,9-Trihydroxy-3,3-dimethyl-3H-4,12-dioxa-benzo[a]anthracen-7-one 6,8,9-trihydroxy-3,3-dimethyl-3H,7H-pyrano[2,3-c]xanthen-7-one 3H,7H-pyrano[2,3-c]xanthen-7-one, 6,8,9-trihydroxy-3,3-dimethyl- InChI=1/C18H14O6/c1-18(2)6-5-8-12(24-18)7-10(20)13-16(22)14-11(23-17(8)13)4-3-9(19)15(14)21/h3-7,19-21H,1-2H3 QFCIGJXDFQIUTI-UHFFFAOYAZ 1,7,8-Trihydroxy-2,2-dimethylpyrano[5',6':3,4]xanthone Globulixanthone C . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-(5-Hydroxy-4-methoxy-7-methyl-naphthalen-1-yl)-8-methoxy-1,2,3-trimethyl-1,2,3,4-tetrahydro-isoquinolin-6-ol rel-(1R,3R)-7-(5-hydroxy-4-methoxy-7-methyl-1-naphthyl)-8-methoxy-1,2,3-trimethyl-1,2,3,4-tetrahydroisoquinolin-6-ol 6-isoquinolinol, 1,2,3,4-tetrahydro-7-(5-hydroxy-4-methoxy-7-methyl-1-naphthalenyl)-8-methoxy-1,2,3-trimethyl-, (1S,3S)- InChI=1/C25H29NO4/c1-13-9-18-17(7-8-21(29-5)23(18)19(27)10-13)24-20(28)12-16-11-14(2)26(4)15(3)22(16)25(24)30-6/h7-10,12,14-15,27-28H,11H2,1-6H3/t14-,15-/m0/s1 UGEJDUMBFTVARC-GJZGRUSLBH Ancistrogriffine A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-Hydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3,7-bis-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-chromen-4-one 3-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-7-yl rel-beta-D-glucopyranoside 4H-1-benzopyran-4-one, 3,7-bis(beta-D-glucopyranosyloxy)-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)- InChI=1/C28H32O17/c1-40-13-4-9(2-3-11(13)31)25-26(45-28-24(39)22(37)19(34)16(8-30)44-28)20(35)17-12(32)5-10(6-14(17)42-25)41-27-23(38)21(36)18(33)15(7-29)43-27/h2-6,15-16,18-19,21-24,27-34,36-39H,7-8H2,1H3/t15-,16-,18-,19-,21+,22+,23-,24-,27-,28+/m1/s1 ZYYJHXKSQKLEBL-QDYVESOYBH Isorhamnetin 3,7-O-di-β-D-glucopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 5-[2,4-dimethyl-3-(7,8,13-trihydroxy-4,8,12-trimethyl-trideca-3,11-dienyl)-7-oxa-bicyclo[2.2.1]hept-2-yl]-2-methyl-pent-2-enyl ester (2E)-5-{(1R,2R,3R,4S)-2,4-dimethyl-3-[(3E,11E)-7,8,13-trihydroxy-4,8,12-trimethyltrideca-3,11-dien-1-yl]-7-oxabicyclo[2.2.1]hept-2-yl}-2-methylpent-2-en-1-yl rel-acetate 2,10-tridecadiene-1,6,7-triol, 13-[(1S,2R,3R,4R)-3-[(3E)-5-(acetyloxy)-4-methyl-3-pentenyl]-1,3-dimethyl-7-oxabicyclo[2.2.1]hept-2-yl]-2,6,10-trimethyl-, (2E,10E)- InChI=1/C32H54O6/c1-23(15-16-28(35)31(6,36)19-10-12-24(2)21-33)11-8-14-27-30(5,29-17-20-32(27,7)38-29)18-9-13-25(3)22-37-26(4)34/h11-13,27-29,33,35-36H,8-10,14-22H2,1-7H3/b23-11+,24-12+,25-13+/t27-,28?,29-,30-,31?,32+/m1/s1 MIYUGOVPVJJFCL-BWBHPFSHBP Concentricol D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(3beta,5xi,9xi,13alpha,18xi,19alpha,20beta)-30-oxo-13,30-epoxyurs-11-en-3-yl acetate urs-11-en-30-one, 3-(acetyloxy)-13,30-epoxy-, (3beta,5xi,9xi,13alpha,18xi,19alpha,20beta)- InChI=1/C32H48O4/c1-19-21-9-13-28(5)17-18-31(8)30(7)15-10-22-27(3,4)24(35-20(2)33)12-14-29(22,6)23(30)11-16-32(31,25(19)28)36-26(21)34/h11,16,19,21-25H,9-10,12-15,17-18H2,1-8H3/t19-,21-,22?,23?,24+,25?,28-,29+,30-,31+,32-/m1/s1 SRUJVPRJIUIPMG-NDVDBPDDBD 3β-Acetoxy-11-ursen-13α,30-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
N-(3-Acetylamino-4,5-dihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yl)-2-amino-acetamide 2-(acetylamino)-2-deoxy-N-glycylhexopyranosylamine hexopyranosylamine, 2-(acetylamino)-N-(aminoacetyl)-2-deoxy- InChI=1/C10H19N3O6/c1-4(15)12-7-9(18)8(17)5(3-14)19-10(7)13-6(16)2-11/h5,7-10,14,17-18H,2-3,11H2,1H3,(H,12,15)(H,13,16) DTVYZCLKXLKNRH-UHFFFAOYAH N-(2-Acetamido-2-deoxy-βglucopyranosyl)glycinamide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(5xi,9xi,10alpha,13alpha)-16,17-dihydroxykauran-18-yl 6-O-[3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]hexopyranoside butanamide, N-[(3S,3aR,9S,10S,10aR,12aR,12bS)-3-[(1S)-1-(dimethylamino)ethyl]-1,2,3,3a,4,7,8,9,10,10a,11,12,12a,12b-tetradecahydro-10-(hydroxymethyl)-3a,10,12b-trimethylbenzo[4,5]cyclohept[1,2-e]inden InChI=1/C31H52O12/c1-27(7-3-8-28(2)19(27)6-9-29-10-17(4-5-20(28)29)30(38,12-29)13-32)15-41-25-23(36)22(35)21(34)18(43-25)11-40-26-24(37)31(39,14-33)16-42-26/h17-26,32-39H,3-16H2,1-2H3/t17?,18?,19?,20?,21?,22?,23?,24?,25?,26?,27-,28+,29+,30+,31?/m0/s1 KOBTXYAFZUGWCB-IHMZMMFWBN Cussovantoside C . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-[6-(4-chlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-2-phenylquinoline quinoline, 4-[6-(4-chlorophenyl)-1,2,4-triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-2-phenyl- InChI=1/C24H14ClN5S/c25-17-12-10-16(11-13-17)23-29-30-22(27-28-24(30)31-23)19-14-21(15-6-2-1-3-7-15)26-20-9-5-4-8-18(19)20/h1-14H ZETAZFJJKDIXKV-UHFFFAOYAG 4-[6-(4-chloro-phenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]-2-phenyl-quinoline . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
N-[3-(1-Dimethylamino-ethyl)-10-hydroxymethyl-3a,10,12b-trimethyl-1,2,3,3a,4,7,8,9,10,10a,11,12,12a,12b-tetradecahydro-benzo[4,5]cyclohepta[1,2-e]inden-9-yl]-2-hydroxy-3,N-dimethyl-butyramide rel-(2R)-N-[(3S,3aR,9S,10S,10aR,12aR,12bS)-3-[(1S)-1-(dimethylamino)ethyl]-10-(hydroxymethyl)-3a,10,12b-trimethyl-1,2,3,3a,4,7,8,9,10,10a,11,12,12a,12b-tetradecahydrobenzo[4,5]cyclohepta[1,2-e]inden-9 InChI=1/C32H54N2O3/c1-20(2)28(36)29(37)34(9)27-13-10-22-18-23-14-16-31(5)24(21(3)33(7)8)15-17-32(31,6)26(23)12-11-25(22)30(27,4)19-35/h14,18,20-21,24-28,35-36H,10-13,15-17,19H2,1-9H3/t21-,24+,25+,26+,27-,28?,30-,31+,32-/m0/s1 WQUVNLRFMHVSNA-WNJCXNBGBR (-)-Buxakarachiamine (20S)-20-Dimethylamino-2'-hydroxy-3β-methyl-3'-methyl-butanoylamino-9,10-seco-buxa-9(11),10(19)-dien-31-ol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(3beta,11alpha,14beta,20S)-11,12,14,20-tetrahydroxypregn-5-en-3-yl hexopyranosyl-(1->4)-6-deoxy-3-O-methylhexopyranosyl-(1->4)-2,6-dideoxy-3-O-methylhexopyranosyl-(1->4)-2,6-dideoxyhexopyranoside hexopyranoside, (3beta,11alpha,14beta,20S)-11,12,14,20-tetrahydroxypregn-5-en-3-yl O-hexopyranosyl-(1->4)-O--6-deoxy-3-O-methylhexopyranosyl-(1->4)-O--2,6-dideoxy-3-O-methylhexopyranosyl-(1->4)-2,6-di InChI=1/C47H78O20/c1-19(49)25-12-14-47(57)26-10-9-23-15-24(11-13-45(23,5)32(26)34(52)42(56)46(25,47)6)63-30-16-27(50)38(20(2)60-30)65-31-17-28(58-7)39(21(3)61-31)66-44-37(55)41(59-8)40(22(4)62-44)67-43-36(54)35(53)33(51)29(18-48)64-43/h9,19-22,24-44,48-5 SLQJNTVCPHOYBN-SBJWCUJDBV Drevogenin D-3-O-β-D-glucopyranosyl-(1→4)-6-deoxy-3-O-methyl-β-D-allopyranosyl-(1→4)-β-D-cymaropyranosyl-(1→4)-β-D-digitoxopyranoside Volubiloside B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(2,3-dichloro-phenyl)-2,6-dimethyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid 3-ethyl ester 5-methyl ester ethyl methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate 3,5-pyridinedicarboxylic acid, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-, ethyl methyl ester InChI=1/C18H19Cl2NO4/c1-5-25-18(23)14-10(3)21-9(2)13(17(22)24-4)15(14)11-7-6-8-12(19)16(11)20/h6-8,15,21H,5H2,1-4H3 RZTAMFZIAATZDJ-UHFFFAOYAS Felodipine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
8-Hydroxy-7-methoxy-6-phenyl-phenalen-1-one 8-hydroxy-7-methoxy-6-phenyl-1H-phenalen-1-one 1H-phenalen-1-one, 8-hydroxy-7-methoxy-6-phenyl- InChI=1/C20H14O3/c1-23-20-17(22)11-15-16(21)10-8-13-7-9-14(19(20)18(13)15)12-5-3-2-4-6-12/h2-11,22H,1H3 FRNMROBOHVJVGF-UHFFFAOYAB 8-Hydroxy-7-methoxy-6-phenylphenalen-1-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-(2-Furan-3-yl-ethyl)-6,7-dimethyl-4,5,6,7-tetrahydro-3H-cyclodeca[c]furan-1-one rel-(6R,7S,8E,10Z)-7-[2-(3-furyl)ethyl]-6,7-dimethyl-4,5,6,7-tetrahydrocyclodeca[c]furan-1(3H)-one cyclodeca[c]furan-1(3H)-one, 7-[2-(3-furanyl)ethyl]-4,5,6,7-tetrahydro-6,7-dimethyl-, (6R,7S,8E,10Z)- InChI=1/C20H24O3/c1-15-6-7-17-14-23-19(21)18(17)5-3-4-10-20(15,2)11-8-16-9-12-22-13-16/h3-5,9-10,12-13,15H,6-8,11,14H2,1-2H3/b5-3-,10-4+/t15-,20+/m1/s1 YOTWCVLUMOQAFC-CIGQNIJYBG 15,16-Epoxy-5,10-seco-clerodan-1(10),2,4,13(16),14-pentaen-18,19-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,3,5,7b-Tetramethyl-1a,3,4,4a,5,7b-hexahydro-1H-cyclopropa[e]azulene-2,6-dione rel-(1aR,4aR,5R,7bS)-3,3,5,7b-tetramethyl-1a,3,4,4a,5,7b-hexahydro-1H-cyclopropa[e]azulene-2,6-dione 1H-cycloprop[e]azulene-2,6-dione, 1a,3,4,4a,5,7b-hexahydro-3,3,5,7b-tetramethyl-, (1aR,4aR,5R,7bS)- InChI=1/C15H20O2/c1-8-9-6-14(2,3)13(17)11-7-15(11,4)10(9)5-12(8)16/h5,8-9,11H,6-7H2,1-4H3/t8-,9-,11+,15-/m1/s1 JMDSVFSLIQKRFD-LIEMUPCEBU Isoomphadione . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Hydroxy-6-hydroxymethyl-3,6,7b-trimethyl-decahydro-cyclobuta[e]inden-4-one rel-(2aR,3R,4aS,6S,7aS,7bR)-3-hydroxy-6-(hydroxymethyl)-3,6,7b-trimethyldecahydro-4H-cyclobuta[e]inden-4-one 4H-cyclobut[e]inden-4-one, decahydro-3-hydroxy-6-(hydroxymethyl)-3,6,7b-trimethyl-, (2aR,3R,4aS,6S,7aS,7bR)- InChI=1/C15H24O3/c1-13(8-16)6-9-10(7-13)14(2)5-4-11(14)15(3,18)12(9)17/h9-11,16,18H,4-8H2,1-3H3/t9-,10-,11+,13+,14+,15+/m0/s1 HSASJPCIWZMQPM-PAUVFPHUBI Illudiolone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Benzo[1,3]dioxol-5-yl-5,7-dimethoxy-chroman 2-(1,3-benzodioxol-5-yl)-5,7-dimethoxychromane 2H-1-benzopyran, 2-(1,3-benzodioxol-5-yl)-3,4-dihydro-5,7-dimethoxy-, (2S)- InChI=1/C18H18O5/c1-19-12-8-16(20-2)13-4-6-14(23-17(13)9-12)11-3-5-15-18(7-11)22-10-21-15/h3,5,7-9,14H,4,6,10H2,1-2H3/t14-/m0/s1 NNIHTBLNMJICQR-AWEZNQCLBM (2S)-3',4'-Methylenedioxy-5,7-dimethoxyflavan . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(4-Hydroxy-3-methoxy-phenyl)-acrylic acid 3-(3,4-dihydroxy-phenyl)-3-methoxy-2-oxo-propyl ester 3-(3,4-dihydroxyphenyl)-3-methoxy-2-oxopropyl (2E)-3-(4-hydroxy-3-methoxyphenyl)acrylate 2-propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, 3-(3,4-dihydroxyphenyl)-3-methoxy-2-oxopropyl ester, (2E)- InChI=1/C20H20O8/c1-26-18-9-12(3-6-15(18)22)4-8-19(25)28-11-17(24)20(27-2)13-5-7-14(21)16(23)10-13/h3-10,20-23H,11H2,1-2H3/b8-4+ BMUMFENOGAOBAV-XBXARRHUBZ 2'-oxo-3'-methoxyl-3'-(3,4-dihydroxyphenyl)-propoxyl-3-(3-hydroxy-4-methoxyphenyl)-2E-propenoate Cimiracemate D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
9-(6-Hydroxy-benzo[1,3]dioxol-5-yl)-7,8-dimethyl-8,9-dihydro-7H-naphtho[1,2-d][1,3]dioxol-6-one rel-(7R,8S,9R)-9-(6-hydroxy-1,3-benzodioxol-5-yl)-7,8-dimethyl-8,9-dihydronaphtho[1,2-d][1,3]dioxol-6(7H)-one naphtho[1,2-d]-1,3-dioxol-6(7H)-one, 8,9-dihydro-9-(6-hydroxy-1,3-benzodioxol-5-yl)-7,8-dimethyl-, (7S,8R,9S)- InChI=1/C20H18O6/c1-9-10(2)19(22)11-3-4-14-20(26-8-23-14)18(11)17(9)12-5-15-16(6-13(12)21)25-7-24-15/h3-6,9-10,17,21H,7-8H2,1-2H3/t9-,10-,17-/m0/s1 IWVMYNUBGFIYHI-YMNVWFMLBD (7'R,8'S,8S)-2'-Hydroxy-3,4:4',5'-bis-(methylenedioxy)-7-oxo-2,7'-cyclolignan . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,4,5-Trihydroxy-6-(5-hydroxy-6-methoxy-4-oxo-2-phenyl-4H-chromen-7-yloxy)-tetrahydro-pyran-2-carboxylic acid 5-hydroxy-6-methoxy-4-oxo-2-phenyl-4H-chromen-7-yl alpha-galactopyranosiduronic acid 4H-1-benzopyran-4-one, 7-(beta-D-galactopyranuronosyloxy)-5-hydroxy-6-methoxy-2-phenyl- InChI=1/C22H20O11/c1-30-19-13(32-22-18(27)16(25)17(26)20(33-22)21(28)29)8-12-14(15(19)24)10(23)7-11(31-12)9-5-3-2-4-6-9/h2-8,16-18,20,22,24-27H,1H3,(H,28,29)/t16-,17+,18+,20-,22+/m0/s1 QXIPXNZUEQYPLZ-ICTYFKLBBC Baicalein 6-methylether-7-O-β-galactopyranuronoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1R,3aR,5'R,7aR)-5'-hydroxy-4,4',5-trimethoxy-2,3-dihydro-2'H-spiro[10-aza-3a,7a-(epiminoethano)indene-1,1'-cyclopent[3]ene]-2',6(7H)-dione [1,3]dioxolo[4,5-g]indolo[3,3a-c]isoquinolin-6(6aH)-one, 3,4,4a,5,7,8-hexahydro-7-[2-(4-hydroxyphenyl)ethyl]-3-methoxy-5-methyl-, (3S,4aS,6aS,13bS)- InChI=1/C18H23NO6/c1-23-11-8-12(21)17(14(11)22)4-5-18-15(25-3)13(24-2)10(20)9-16(17,18)6-7-19-18/h8,14,19,22H,4-7,9H2,1-3H3/t14-,16+,17-,18-/m1/s1 AZJUVLFKQSBGNE-BZZMCLGOBH Dechloroacutumidine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(3R,4aR,6aR,13bR)-7-[2-(4-hydroxyphenyl)ethyl]-3-methoxy-5-methyl-3,4,4a,5,7,8-hexahydro[1,3]dioxolo[4,5-g]indolo[3,3a-c]isoquinolin-6(6aH)-one [1,3]dioxolo[4,5-g]indolo[3,3a-c]isoquinolin-6(6aH)-one, 3,4,4a,5,7,8-hexahydro-7-[2-(4-hydroxyphenyl)ethyl]-3-methoxy-5-methyl-, (3S,4aS,6aS,13bS)- InChI=1/C26H28N2O5/c1-27-23-12-19(31-2)7-9-26(23)20-13-22-21(32-15-33-22)11-17(20)14-28(24(26)25(27)30)10-8-16-3-5-18(29)6-4-16/h3-7,9,11,13,19,23-24,29H,8,10,12,14-15H2,1-2H3/t19-,23+,24-,26+/m1/s1 MNZZTIOCKJEHEP-XVZHEKKHBM 3S,4aS,11S,10bS-3,4,4a,13,11,5,6-heptahydro-5[2-(4-hydroxyphenyl)ethyl]-3-methoxy-13-methyl-[1,3-dioxolo[4,5-g]indolo[3,3a-c]]-isoquinolin-12-one Obliquine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
12,13,14,26,27,28-Hexahydroxy-3,7,17,21-tetramethyl-3,17-divinyl-2,9,16,23,29,30-hexaoxa-tricyclo[23.3.1.1^(11,15)]triaconta-6,20-diene-8,22-dione (6E,20E)-12,13,14,26,27,28-hexahydroxy-3,7,17,21-tetramethyl-3,17-divinyl-2,9,16,23,29,30-hexaoxatricyclo[23.3.1.1~11,15~]triaconta-6,20-diene-8,22-dione (non-preferred name) benzeneethanol, 4-hydroxy-beta-methoxy-, (betaR)- InChI=1/C32H48O14/c1-7-31(5)13-9-11-17(3)27(39)42-16-20-22(34)24(36)26(38)30(44-20)46-32(6,8-2)14-10-12-18(4)28(40)41-15-19-21(33)23(35)25(37)29(43-19)45-31/h7-8,11-12,19-26,29-30,33-38H,1-2,9-10,13-16H2,3-6H3/b17-11+,18-12+ IINZASCKGHCXIA-JYFOCSDGBF Dicliripariside A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(2-Hydroxy-1-methoxy-ethyl)-phenol 4-(2-hydroxy-1-methoxyethyl)phenol benzeneethanol, 4-hydroxy-beta-methoxy-, (betaR)- InChI=1/C9H12O3/c1-12-9(6-10)7-2-4-8(11)5-3-7/h2-5,9-11H,6H2,1H3/t9-/m0/s1 UHDDGONMYAQWBV-VIFPVBQEBZ 2-Methoxy-2-(4'-hydroxyphenyl)ethanol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Benzoic acid 4,5,12-triacetoxy-6-acetoxymethyl-2-hydroxy-2,10,10-trimethyl-11-oxa-tricyclo[7.2.1.0^(1,6)]dodec-7-yl ester (3R,5S,5aR,6R,7S,9S,9aS,10R)-6,7,10-tris(acetyloxy)-5a-[(acetyloxy)methyl]-9-hydroxy-2,2,9-trimethyloctahydro-2H-3,9a-methano-1-benzoxepin-5-yl rel-benzoate 2H-3,9a-methano-1-benzoxepin-5,6,7,9,10-pentol, 5a-[(acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 6,7,10-triacetate 5-benzoate, (3R,5S,5aR,6R,7S,9S,9aS,10R)- InChI=1/C30H38O12/c1-16(31)37-15-29-23(41-26(35)20-11-9-8-10-12-20)13-21-24(39-18(3)33)30(29,42-27(21,5)6)28(7,36)14-22(38-17(2)32)25(29)40-19(4)34/h8-12,21-25,36H,13-15H2,1-7H3/t21-,22+,23+,24-,25+,28+,29-,30+/m1/s1 SUKGHCPJNGDNSA-WBDMUUHOBP 4-Hydroxy-1,2,6,15-tetraacetyl-9-benzoylagarofuran . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-N-({[(3R,6R,9S,12R,15S)-3-benzyl-6,7-dimethyl-12-[(1R)-1-methylpropyl]-2,5,8,11,14-pentaoxo-9-(2-phenylethyl)-1,4,7,10,13-pentaazacyclononadecan-15-yl]amino}carbonyl)-L-alloisoleucine benzene, 1,2,4-trimethoxy-5-[(1E)-1-propenyl]- InChI=1/C42H61N7O8/c1-7-26(3)34-39(53)44-32(23-22-29-17-11-9-12-18-29)40(54)49(6)28(5)36(50)45-33(25-30-19-13-10-14-20-30)37(51)43-24-16-15-21-31(38(52)47-34)46-42(57)48-35(41(55)56)27(4)8-2/h9-14,17-20,26-28,31-35H,7-8,15-16,21-25H2,1-6H3,(H,43,51)(H,44 UHGIIADZWWCEKS-ZOTLXPJXBC Schizopeptin 791 . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,2,4-trimethoxy-5-propenyl-benzene 1,2,4-trimethoxy-5-[(1E)-prop-1-en-1-yl]benzene benzene, 1,2,4-trimethoxy-5-[(1E)-1-propenyl]- InChI=1/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5+ RKFAZBXYICVSKP-AATRIKPKBQ (E)-1,2,4-trimethoxy-5-prop-1-enylbenzene (E)-Asarone 1,2,4-trimethoxy-5-trans-propenyl-benzene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-[6-(3,4-Dihydroxy-4-hydroxymethyl-tetrahydro-furan-2-yloxymethyl)-3,4,5-trihydroxy-tetrahydro-pyran-2-yloxy]-benzoic acid methyl ester methyl 2-({6-O-[3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]hexopyranosyl}oxy)benzoate benzoic acid, 2-[[6-O-[tetrahydro-3,4-dihydroxy-4-(hydroxymethyl)-2-furanyl]hexopyranosyl]oxy]-, methyl ester InChI=1/C19H26O12/c1-27-16(25)9-4-2-3-5-10(9)30-17-14(23)13(22)12(21)11(31-17)6-28-18-15(24)19(26,7-20)8-29-18/h2-5,11-15,17-18,20-24,26H,6-8H2,1H3 ZOIVCDCWDFQVRB-UHFFFAOYAF Canthoside A Methyl 2-hydroxybenzoate 2-O-β-D-apiofuranosyl-(1→6)-O-β-D-glucopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-Hydroxymethyl-1-[2-(4-hydroxy-phenyl)-ethyl]-1H-pyrrole-2-carbaldehyde 5-(hydroxymethyl)-1-[2-(4-hydroxyphenyl)ethyl]-1H-pyrrole-2-carbaldehyde 1H-pyrrole-2-carboxaldehyde, 5-(hydroxymethyl)-1-[2-(4-hydroxyphenyl)ethyl]- InChI=1/C14H15NO3/c16-9-12-3-4-13(10-17)15(12)8-7-11-1-5-14(18)6-2-11/h1-6,9,17-18H,7-8,10H2 KPSZYAMCIRWUTK-UHFFFAOYAP 5-Hydroxymethyl-1-[2-(4-hydroxyphenyl)-ethyl]-1H-pyrrole-2-carbaldehyde Pyrrolezanthine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-[3-Hydroxymethyl-5-(3-hydroxy-propenyl)-7-methoxy-2,3-dihydro-benzofuran-2-yl]-2,6-dimethoxy-phenol rel-4-{(2R,3S)-3-(hydroxymethyl)-5-[(1E)-3-hydroxyprop-1-en-1-yl]-7-methoxy-2,3-dihydro-1-benzofuran-2-yl}-2,6-dimethoxyphenol 3-benzofuranmethanol, 2,3-dihydro-2-(4-hydroxy-3,5-dimethoxyphenyl)-5-[(1E)-3-hydroxy-1-propenyl]-7-methoxy-, (2R,3S)- InChI=1/C21H24O7/c1-25-16-9-13(10-17(26-2)19(16)24)20-15(11-23)14-7-12(5-4-6-22)8-18(27-3)21(14)28-20/h4-5,7-10,15,20,22-24H,6,11H2,1-3H3/b5-4+/t15-,20+/m1/s1 SGRRPSBKBJVKJE-SQBHOSFOBL (-)-Simulanol 4-[3-Hydroxymethyl-5-((E)-3-hydroxypropenyl)-7-methoxy-2,3-dihydrobenzofuran-2-yl]-2,6-dimethoxy-phenol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(6alpha,7alpha,14beta,17alpha,22R,23S)-6,7,23-trihydroxy-14,22:22,25-diepoxyergosta-4,8,11-trien-3-one ergosta-4,8,11-trien-3-one, 14,22:22,25-diepoxy-6,7,23-trihydroxy-, (6alpha,7alpha,14beta,17alpha,22S,23R)- InChI=1/C28H38O6/c1-14-17-9-12-27(34-28(14)23(32)15(2)24(3,4)33-28)20-18(8-11-26(17,27)6)25(5)10-7-16(29)13-19(25)21(30)22(20)31/h8,11,13-15,17,21-23,30-32H,7,9-10,12H2,1-6H3/t14-,15-,17+,21+,22-,23+,25+,26+,27-,28-/m0/s1 GKTIPUYIQKAQLI-XBUYSURHBD (20S,22S,23R,24S)-14β,22:22,25-diepoxy-6α,7α,23-trihydroxyergosta-4,8,11-trien-3-one Blazeispirol V . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
10,11-Dihydroxy-9-[3-(4-hydroxy-phenyl)-acryloyloxymethyl]-1,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydro-2H-picene-4a-carboxylic acid (2alpha,3beta,5xi,9xi,18xi)-2,3-dihydroxy-24-{[(2Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}urs-12-en-28-oic acid urs-12-en-28-oic acid, 2,3-dihydroxy-24-[[(2Z)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]oxy]-, (2alpha,3beta,5xi,9xi,18xi)- InChI=1/C39H54O7/c1-23-15-18-39(34(44)45)20-19-37(5)27(32(39)24(23)2)12-13-30-35(3)21-28(41)33(43)36(4,29(35)16-17-38(30,37)6)22-46-31(42)14-9-25-7-10-26(40)11-8-25/h7-12,14,23-24,28-30,32-33,40-41,43H,13,15-22H2,1-6H3,(H,44,45)/b14-9-/t23-,24+,28-,29?,3 ADBNLBJPUAZWEK-JMDKDFBDBG 2α,3β-Dihydroxy-24-p-z-coumaroyloxyurs-12-en-28-oic acid Guavacoumaric acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Methyl-butan-2-one O-vinyl-oxime (2E)-3-methylbutan-2-one O-vinyloxime 2-butanone, 3-methyl-, O-ethenyloxime, (2E)- InChI=1/C7H13NO/c1-5-9-8-7(4)6(2)3/h5-6H,1H2,2-4H3/b8-7+ CVRBHPINIDOAJA-BQYQJAHWBZ (E)-O-Vinylmethylisopropylketoxime . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(3R,13R,14S,17S,18R,19R,20S,21S,22R,24R,25S)-21-(acetyloxy)-20-[(acetyloxy)methyl]-18,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-22-(propionyloxy)-2,5,16-trioxa-11-azapentacyclo[15.7.1.0~1,20~.0~3 L-cysteine, S-(2-hydroxyethyl)- InChI=1/C47H51NO17/c1-8-31(51)61-35-32-36(62-41(54)28-16-11-9-12-17-28)47-45(7,57)37(63-40(53)25(3)24(2)33-30(20-15-21-48-33)43(56)59-22-44(32,6)65-47)34(52)38(64-42(55)29-18-13-10-14-19-29)46(47,23-58-26(4)49)39(35)60-27(5)50/h9-21,24-25,32,34-39,52,57H MSSOSOXUURLBHN-QQHMQPKJBZ Euophelline . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Amino-3-(2-hydroxy-ethylsulfanyl)-propionic acid S-(2-hydroxyethyl)cysteine L-cysteine, S-(2-hydroxyethyl)- InChI=1/C5H11NO3S/c6-4(5(8)9)3-10-2-1-7/h4,7H,1-3,6H2,(H,8,9)/t4-/m0/s1 MWFRVMDVLYIXJF-BYPYZUCNBT (R)-S-(2-Hydroxyethyl)cysteine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
S-benzyl 2-hydroxyethanesulfinothioate ethanesulfinothioic acid, 2-hydroxy-, S-(phenylmethyl) ester InChI=1/C9H12O2S2/c10-6-7-13(11)12-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2 JHSIPSLAQVGISO-UHFFFAOYAM S-Benzyl (2-hydroxyethane)thiosulfinate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(4,5-Dihydroxy-1,5-dimethyl-hexyl)-5-methyl-benzene-1,4-diol rel-2-[(1R,4S)-4,5-dihydroxy-1,5-dimethylhexyl]-5-methylbenzene-1,4-diol 1,4-benzenediol, 2-[(1R,4S)-4,5-dihydroxy-1,5-dimethylhexyl]-5-methyl- InChI=1/C15H24O4/c1-9(5-6-14(18)15(3,4)19)11-8-12(16)10(2)7-13(11)17/h7-9,14,16-19H,5-6H2,1-4H3/t9-,14+/m1/s1 TXJTUGYAWQRATI-OTYXRUKQBP Helibisabonol A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
N-(1,4,7,7-Tetramethyl-1,2,3,3a,4,5,5a,6,7,8,9,10,10a,10b-tetradecahydro-pyren-1-yl)-formamide rel-N-[(1R,4R)-1,4,7,7-tetramethyl-1,2,3,3a,4,5,5a,6,7,8,9,10,10a,10b-tetradecahydropyren-1-yl]formamide formamide, [(1S,4S)-1,2,3,3a,4,5,5a,6,7,8,9,10,10a,10b-tetradecahydro-1,4,7,7-tetramethyl-1-pyrenyl]- InChI=1/C21H33NO/c1-13-9-15-11-20(2,3)10-14-5-6-17-19(18(14)15)16(13)7-8-21(17,4)22-12-23/h12-13,15-17,19H,5-11H2,1-4H3,(H,22,23)/t13-,15?,16?,17?,19?,21-/m0/s1 SYYCXXTWCFHRJV-YAVMPCOKBC N-Formyl-7-amino-11-cycloamphilectene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(19E)-3,4,5,6-tetradehydrocoryn-19-en-4-ium-1-id-17-ol 1H-indolo[2,3-a]quinolizin-5-ium, 3-ethylidene-2,3,4,12-tetrahydro-2-(2-hydroxyethyl)-, inner salt, (2R,3E)- InChI=1/C19H20N2O/c1-2-13-12-21-9-7-16-15-5-3-4-6-17(15)20-19(16)18(21)11-14(13)8-10-22/h2-7,9,14,22H,8,10-12H2,1H3/b13-2-/t14-/m0/s1 ICJZOHPEKMAUGQ-VMPILDALBV 3,4,5,6-Tetradehydrogeissoschizol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,6,8-Tribromo-dibenzo[1,4]dioxin-1-ol 3,6,8-tribromooxanthren-1-ol dibenzo[b,e][1,4]dioxin-1-ol, 3,6,8-tribromo- InChI=1/C12H5Br3O3/c13-5-1-7(15)11-9(3-5)18-12-8(16)2-6(14)4-10(12)17-11/h1-4,16H XZPITRJUKODSMI-UHFFFAOYAK Spongiadioxin C . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(2-Hydroxy-ethyl)-4-methoxy-5-methyl-6-(3-methyl-but-2-enyloxy)-2,3-dihydro-isoindol-1-one 2-(2-hydroxyethyl)-4-methoxy-5-methyl-6-[(3-methylbut-2-en-1-yl)oxy]isoindolin-1-one 1H-isoindol-1-one, 2,3-dihydro-2-(2-hydroxyethyl)-4-methoxy-5-methyl-6-[(3-methyl-2-butenyl)oxy]- InChI=1/C17H23NO4/c1-11(2)5-8-22-15-9-13-14(16(21-4)12(15)3)10-18(6-7-19)17(13)20/h5,9,19H,6-8,10H2,1-4H3 RKLUTDADUQVUMB-UHFFFAOYAQ 2-(2'-Hydroxyethyl)-4-methoxy-5-methyl-6-(3''-methyl-2''-butenyloxy)-2,3-dihydro-1H-isoindol-1-one 2-(2\'-Hydroxyethyl)-4-methoxy-5-methyl-6-(3\'\'-methyl-2\'\'-butenyloxy)-2,3-dihydro-1H-isoindol-1-one Porritoxin . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-(5-Oxo-5,6-dihydro-benzo[c][2,7]naphthyridin-4-yl)-nicotinic acid methyl ester methyl 2-(5-oxo-5,6-dihydrobenzo[c]-2,7-naphthyridin-4-yl)nicotinate 3-pyridinecarboxylic acid, 2-(5,6-dihydro-5-oxobenzo[c][2,7]naphthyridin-4-yl)-, methyl ester InChI=1/C19H13N3O3/c1-25-19(24)13-6-4-9-20-16(13)17-15-12(8-10-21-17)11-5-2-3-7-14(11)22-18(15)23/h2-10H,1H3,(H,22,23) QTEMOSHKMIGNSF-UHFFFAOYAT Subarine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 17-(4,5-dihydro-furan-3-yl)-6-hydroxy-4,4,8,10,13-pentamethyl-3-oxo-4,5,6,7,8,9,10,11,12,13,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-7-yl ester (6alpha,7alpha,9xi,13alpha,17alpha)-17-(4,5-dihydrofuran-3-yl)-6-hydroxy-4,4,8-trimethyl-3-oxoandrosta-1,14-dien-7-yl acetate androsta-1,14-dien-3-one, 7-(acetyloxy)-17-(4,5-dihydro-3-furanyl)-6-hydroxy-4,4,8-trimethyl-, (6alpha,7alpha,9xi,13alpha,17alpha)- InChI=1/C28H38O5/c1-16(29)33-24-22(31)23-25(2,3)21(30)10-13-27(23,5)20-9-12-26(4)18(17-11-14-32-15-17)7-8-19(26)28(20,24)6/h8,10,13,15,18,20,22-24,31H,7,9,11-12,14H2,1-6H3/t18-,20?,22+,23?,24+,26-,27+,28-/m0/s1 DQHRAIFEHNKZSV-XXHRVKQKBL 22,23-Dihydronimocinol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
methyl rel-[(1R,2R,4R,4aS,6aR,7S,10aS,11cR,12R)-7-(3-furyl)-1,3a,11c-trihydroxy-2,4,6a-trimethyl-9-oxotetradecahydro-1H-2,4-methanofuro[2',3',4',5':4,5]fluoreno[3,4-c]pyran-12-yl]acetate 2,4-methano-1H-furo[2',3',4',5':4,5]fluoreno[3,4-c]pyran-12-acetic acid, 7-(3-furanyl)tetradecahydro-1,3a,11c-trihydroxy-2,4,6a-trimethyl-9-oxo-, methyl ester, (1S,2S,4S,4aR,6aS,7R,10aR,11cS,12S)- InChI=1/C27H34O9/c1-22-12-25(31)19-18(20(22)30)36-26-10-17(29)35-21(13-6-8-34-11-13)23(26,2)7-5-14(27(19,26)32)24(25,3)15(22)9-16(28)33-4/h6,8,11,14-15,18-21,30-32H,5,7,9-10,12H2,1-4H3/t14-,15+,18?,19?,20-,21+,22+,23+,24-,25?,26-,27+/m1/s1 LVKULLURUFYYEU-ZARBDQLIBX Khayanolide D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,4-dibromo-5-methoxyphenol phenol, 2,4-dibromo-5-methoxy- InChI=1/C7H6Br2O2/c1-11-7-3-6(10)4(8)2-5(7)9/h2-3,10H,1H3 CSWGVJKAOCKWFE-UHFFFAOYAY 2,4-dibromo-5-methoxyphenol . Information we have got: NMR spectra 1H, 3D coordinates, File formats: CML, mol, png, jpeg
2,4-dibromo-6-methoxyphenol phenol, 2,4-dibromo-6-methoxy- InChI=1/C7H6Br2O2/c1-11-6-3-4(8)2-5(9)7(6)10/h2-3,10H,1H3 LAONXLSELHLPBP-UHFFFAOYAL 2,4-dibromo-6-methoxyphenol . Information we have got: NMR spectra 1H, 3D coordinates, File formats: CML, mol, png, jpeg
10-Hexadecylperoxy-4,4,4a,6a,6b,9,9,12a-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydro-picene (6aR,6bS,8aS,14bR)-4,4,6a,6b,8a,9,9,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl rel-hexadecanoate (non-preferred name) hexadecanoic acid, (6aR,6bS,8aS,14bR)-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-eicosahydro-4,4,6a,6b,8a,9,9,14b-octamethyl-3-picenyl ester InChI=1/C46H80O2/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-25-40(47)48-39-29-31-43(6)37(42(39,4)5)28-32-46(9)38(43)27-26-36-35-24-23-30-41(2,3)44(35,7)33-34-45(36,46)8/h26,35,37-39H,10-25,27-34H2,1-9H3/t35?,37?,38?,39?,43-,44-,45+,46+/m0/s1 LFBNQDYKXBDQSB-PJJYJDFDBO Kairatenyl Palmitate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1R,8R,10S,13S,15R,22R,29S)-9,30-dioxa-11,25-diazapentacyclo[20.6.2.2~8,11~.0~10,15~.0~25,29~]dotriacontan-13-ol (non-preferred name) phenol, 4-(1,3-dioxolo[4,5-g]isoquinolin-5-ylmethyl)- InChI=1/C28H50N2O3/c31-24-20-23-11-6-2-4-8-13-25-15-18-29-17-9-12-22(27(29)32-25)10-5-1-3-7-14-26-16-19-30(21-24)28(23)33-26/h22-28,31H,1-21H2/t22-,23-,24+,25-,26-,27+,28+/m1/s1 GZPZPDSNGIBVLB-SIOWMNFYBE (+)-7-Hydroxyxestospongin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-[1,3]Dioxolo[4,5-g]isoquinolin-5-ylmethyl-phenol 4-([1,3]dioxolo[4,5-g]isoquinolin-5-ylmethyl)phenol phenol, 4-(1,3-dioxolo[4,5-g]isoquinolin-5-ylmethyl)- InChI=1/C17H13NO3/c19-13-3-1-11(2-4-13)7-15-14-9-17-16(20-10-21-17)8-12(14)5-6-18-15/h1-6,8-9,19H,7,10H2 KRHLIEJPAKUMIW-UHFFFAOYAW 1-(p-hydroxy-benzyl)-6,7-methylenedioxyisoquinoline Neolitacumonine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(3,5-Dihydroxy-phenyl)-2-(4-hydroxy-phenyl)-2,3-dihydro-benzofuran-5-carbaldehyde rel-(2R,3R)-3-(3,5-dihydroxyphenyl)-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-5-carbaldehyde 5-benzofurancarboxaldehyde, 3-(3,5-dihydroxyphenyl)-2,3-dihydro-2-(4-hydroxyphenyl)-, (2R,3R)- InChI=1/C21H16O5/c22-11-12-1-6-19-18(7-12)20(14-8-16(24)10-17(25)9-14)21(26-19)13-2-4-15(23)5-3-13/h1-11,20-21,23-25H/t20-,21+/m1/s1 TYAYDVXOPBERFS-RTWAWAEBBB 3β-(3',5'-Dihydroxyphenyl)-2α-(4''-hydroxyphenyl)dihydrobenzofuran-5-carbaldehyde . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(5xi,11beta,12beta)-11,12-dihydroxy-16-oxostachan-18-oic acid phenol, 4,6-dibromo-3-chloro-2-methoxy- InChI=1/C20H30O5/c1-17-6-4-7-18(2,16(24)25)11(17)5-8-20-9-12(21)19(3,10-20)15(23)13(22)14(17)20/h11,13-15,22-23H,4-10H2,1-3H3,(H,24,25)/t11?,13-,14+,15-,17-,18-,19+,20+/m1/s1 PLZLOCWVDAXVNW-CGPCUBAEBJ ent-11α,12α-Dihydroxy-16-ketobeyeran-19-oic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4,6-dibromo-3-chloro-2-methoxyphenol phenol, 4,6-dibromo-3-chloro-2-methoxy- InChI=1/C7H5Br2ClO2/c1-12-7-5(10)3(8)2-4(9)6(7)11/h2,11H,1H3 YBZMUJSMBKGBLR-UHFFFAOYAC 4,6-dibromo-3-chloro-2-methoxyphenol . Information we have got: NMR spectra 1H, 3D coordinates, File formats: CML, mol, png, jpeg
3-[13-Hydroxymethyl-3-(1-hydroxy-1-methyl-ethyl)-15-isopropenyl-4,9,10-trimethyl-hexadecahydro-cyclopenta[a]phenanthren-4-yl]-propionic acid 3-[(3alpha,4beta,5beta,8alpha,9beta,10alpha,13alpha,14beta,15beta)-18-hydroxy-3-(1-hydroxy-1-methylethyl)-15-isopropenyl-4,9-dimethylandrostan-4-yl]propanoic acid propanoic acid, 3-[(3alpha,4beta,5beta,8alpha,9beta,10alpha,13alpha,14beta,15beta)-18-hydroxy-3-(1-hydroxy-1-methylethyl)-4,9-dimethyl-15-(1-methylethenyl)androstan-4-yl]- InChI=1/C30H50O4/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5,13-12-24(32)33)22(26(3,4)34)11-14-29(23,28)7/h20-23,25,31,34H,1,8-18H2,2-7H3,(H,32,33)/t20-,21+,22-,23+,25+,27-,28+,29+,30+/m0/s1 KGMGMWWHHYCAGC-CNRMHUMKBR 4,28-Dihydroxy-3,4-seco-lup-20(29)-en-3-oic acid . Information we have got: NMR spectra 13C, 1H, 3D coordinates, File formats: CML, mol, png, jpeg
4-[3,5-Dihydroxy-7-(4-hydroxy-phenyl)-heptyl]-benzene-1,2-diol rel-4-[(3R,5R)-3,5-dihydroxy-7-(4-hydroxyphenyl)heptyl]benzene-1,2-diol 1,2-benzenediol, 4-[(3R,5R)-3,5-dihydroxy-7-(4-hydroxyphenyl)heptyl]- InChI=1/C19H24O5/c20-15-6-1-13(2-7-15)3-8-16(21)12-17(22)9-4-14-5-10-18(23)19(24)11-14/h1-2,5-7,10-11,16-17,20-24H,3-4,8-9,12H2/t16-,17-/m1/s1 XLTITIJKWVRJMS-IAGOWNOFBI (3R,5R)-Dihydroxy-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptane . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Benzoyl-10-(3-hydroxy-3-methyl-but-1-enyl)-3-(1-hydroxy-1-methyl-ethyl)-11,11-dimethyl-8-(3-methyl-but-2-enyl)-4-oxa-tricyclo[6.3.1.0^(1,5)]dodec-5-ene-7,12-dione rel-(2R,3aR,5S,7R)-9-benzoyl-5-[(1E)-3-hydroxy-3-methylbut-1-en-1-yl]-2-(1-hydroxy-1-methylethyl)-4,4-dimethyl-7-(3-methylbut-2-en-1-yl)-2,3,4,5,6,7-hexahydro-8H-3a,7-methanocycloocta[b]furan-8,10-dio 8H-3a,7-methanocycloocta[b]furan-8,10-dione, 9-benzoyl-2,3,4,5,6,7-hexahydro-5-[(1E)-3-hydroxy-3-methyl-1-butenyl]-2-(1-hydroxy-1-methylethyl)-4,4-dimethyl-7-(3-methyl-2-butenyl)-, (2R,3aR,5S,7R)- InChI=1/C33H42O6/c1-20(2)14-17-32-18-22(15-16-29(3,4)37)30(5,6)33(28(32)36)19-23(31(7,8)38)39-27(33)24(26(32)35)25(34)21-12-10-9-11-13-21/h9-16,22-23,37-38H,17-19H2,1-8H3/b16-15+/t22-,23-,32+,33-/m1/s1 GZADVFQEXFHJPC-KROBLWSZBX Hyperibone H . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(1,1-Dimethyl-allyl)-1,3,5-trihydroxy-2-(3-methyl-but-2-enyl)-xanthen-9-one 4-(1,1-dimethylprop-2-en-1-yl)-1,3,5-trihydroxy-2-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one 9H-xanthen-9-one, 4-(1,1-dimethyl-2-propenyl)-1,3,5-trihydroxy-2-(3-methyl-2-butenyl)- InChI=1/C23H24O5/c1-6-23(4,5)17-20(27)13(11-10-12(2)3)18(25)16-19(26)14-8-7-9-15(24)21(14)28-22(16)17/h6-10,24-25,27H,1,11H2,2-5H3 OXZMCBZLVUVQJT-UHFFFAOYAO 1,3,5-trihydroxy-2-(3-methylbut-2-enyl)-4-(1,1-dimethylprop-2-enyl) xanthone Allanxanthone A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 1-[5-hydroxy-2,2-dimethyl-6-(3-methyl-butyryl)-8-oxo-2H,8H-pyrano[2,3-f]chromen-10-yl]-propyl ester 1-[5-hydroxy-2,2-dimethyl-6-(3-methylbutanoyl)-8-oxo-2H,8H-pyrano[2,3-f]chromen-10-yl]propyl acetate 1,2-naphthalenedicarboxaldehyde, 1,4,4a,5,6,7,8,8a-octahydro-1-hydroxy-5,5,8a-trimethyl-, (1S,4aS,8aS)- InChI=1/C24H28O7/c1-7-17(29-13(4)25)15-11-18(27)30-23-19(15)22-14(8-9-24(5,6)31-22)21(28)20(23)16(26)10-12(2)3/h8-9,11-12,17,28H,7,10H2,1-6H3 ZXVVWQRCGVMJOW-UHFFFAOYAC Mammea E/BA cyclo D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1R,4aR,8aR)-1-hydroxy-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalene-1,2-dicarbaldehyde 1,2-naphthalenedicarboxaldehyde, 1,4,4a,5,6,7,8,8a-octahydro-1-hydroxy-5,5,8a-trimethyl-, (1S,4aS,8aS)- InChI=1/C15H22O3/c1-13(2)7-4-8-14(3)12(13)6-5-11(9-16)15(14,18)10-17/h5,9-10,12,18H,4,6-8H2,1-3H3/t12-,14-,15+/m0/s1 QGMWDUUHVVLHNP-AEGPPILIBL warburganal . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
methyl (4aR,6aR,8S,9R,11aR,11bR)-4,4,9,11b-tetramethyltetradecahydro-9,11a-methanocyclohepta[a]naphthalen-8-yl rel-malonate propanedioic acid, methyl (4aS,6aS,8R,9S,11aS,11bS)-tetradecahydro-4,4,9,11b-tetramethyl-9,11a-methano-11aH-cyclohepta[a]naphthalen-8-yl ester InChI=1/C24H38O4/c1-21(2)9-6-10-23(4)17(21)8-7-16-13-18(28-20(26)14-19(25)27-5)22(3)11-12-24(16,23)15-22/h16-18H,6-15H2,1-5H3/t16-,17-,18+,22-,23-,24-/m0/s1 AHZFYNZHSPWMAG-KUQYMPSYBK (-)-Methylthyrsiflorin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7,16-Dibenzyl-6,15-bis-(2-methoxy-ethoxymethoxymethyl)-1,4,10,13-tetraoxa-7,16-diaza-cyclooctadecane rel-(6R,15R)-7,16-dibenzyl-6,15-bis{[(2-methoxyethoxy)methoxy]methyl}-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane 1,4,10,13-tetraoxa-7,16-diazacyclooctadecane, 6,15-bis[[(2-methoxyethoxy)methoxy]methyl]-7,16-bis(phenylmethyl)-, (6R,15R)- InChI=1/C36H58N2O10/c1-39-17-19-45-31-47-29-35-27-43-23-21-42-16-14-38(26-34-11-7-4-8-12-34)36(30-48-32-46-20-18-40-2)28-44-24-22-41-15-13-37(35)25-33-9-5-3-6-10-33/h3-12,35-36H,13-32H2,1-2H3/t35-,36-/m1/s1 KAEZUYSPRBKHHS-LQFQNGICBN (2R,11R)-2,11-bis{[(2-methoxyethoxy)methoxy]methyl}-1,10-dibenzyl-4,7,13,16-tetraoxa-1,10-diaza-cyclooctadecane . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
17-(2,3-dihydroxy-1,4,5-trimethyl-hexyl)-10,13-dimethyl-3-[3,4,5-trihydroxy-6-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxymethyl)-tetrahydro-pyran-2-yloxy]-hexadecahydro-cyclopenta[a]phenanthren-6-one (3beta,5alpha,8xi,9xi,14xi,17xi,22R,23R)-22,23-dihydroxy-6-oxoergostan-3-yl rel-6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside ergostan-6-one, 3-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-22,23-dihydroxy-, (3beta,5alpha,8xi,9xi,14xi,17xi,22R,23R)- InChI=1/C40H68O14/c1-17(2)18(3)29(43)30(44)19(4)22-7-8-23-21-14-26(42)25-13-20(9-11-40(25,6)24(21)10-12-39(22,23)5)52-38-36(50)34(48)32(46)28(54-38)16-51-37-35(49)33(47)31(45)27(15-41)53-37/h17-25,27-38,41,43-50H,7-16H2,1-6H3/t18-,19+,20+,21?,22?,23?,24? RLRVOEIFUPCQQE-NUSIVRTQBE 24-epi-Teasterone-3-O-β-D-glucopyranosyl-(1→6)-β-D-glucopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-Furan-3-yl-6-hydroxy-3a,7-dimethyl-3a,4,5,6-tetrahydro-3H-isobenzofuran-1-one rel-(3R,3aR,6R)-3-(3-furyl)-6-hydroxy-3a,7-dimethyl-3a,4,5,6-tetrahydro-2-benzofuran-1(3H)-one 1(3H)-isobenzofuranone, 3-(3-furanyl)-3a,4,5,6-tetrahydro-6-hydroxy-3a,7-dimethyl-, (3R,3aR,6R)- InChI=1/C14H16O4/c1-8-10(15)3-5-14(2)11(8)13(16)18-12(14)9-4-6-17-7-9/h4,6-7,10,12,15H,3,5H2,1-2H3/t10-,12+,14-/m1/s1 ZCEUBPHEBYXFLM-SCDSUCTJBV (-)-(3R,3aR,6R)-3-(3'-Furanyl)-3a,7-dimethyl-6-hydroxy-1,3,3a,4,5,6-hexahydrobenzo[c]furan-1-one 9α-Hydroxyfraxinellone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Octa-2,4,6-trienoic acid [2-[2-methyl-1-(4-methyl-2,5-dioxo-pyrrolidine-3-carbonyl)-propylcarbamoyl]-1-phenyl-ethyl]-amide rel-(2E,4E,6E)-N-{(1R)-3-[((1R)-2-methyl-1-{[(3S,4R)-4-methyl-2,5-dioxopyrrolidin-3-yl]carbonyl}propyl)amino]-3-oxo-1-phenylpropyl}octa-2,4,6-trienamide benzenepropanamide, N-[(1S)-2-methyl-1-[[(3R,4S)-4-methyl-2,5-dioxo-3-pyrrolidinyl]carbonyl]propyl]-beta-[[(2E,4E,6E)-1-oxo-2,4,6-octatrienyl]amino]-, (betaS)- InChI=1/C27H33N3O5/c1-5-6-7-8-12-15-21(31)28-20(19-13-10-9-11-14-19)16-22(32)29-24(17(2)3)25(33)23-18(4)26(34)30-27(23)35/h5-15,17-18,20,23-24H,16H2,1-4H3,(H,28,31)(H,29,32)(H,30,34,35)/b6-5+,8-7+,15-12+/t18-,20-,23+,24-/m0/s1 OHDXGZAYYBMHCY-QSUIEZAABH Andrimid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Methyl-5-oxo-hexanoic acid 2-methyl-5-oxohexanoic acid hexanoic acid, 2-methyl-5-oxo- InChI=1/C7H12O3/c1-5(7(9)10)3-4-6(2)8/h5H,3-4H2,1-2H3,(H,9,10) RJKCQJNOJDMYEM-UHFFFAOYAZ 2-Methyl-5-oxohexanoic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
8-Methyl-5,6,7a,8,11a,12,12a,13-octahydro-7H-9-oxa-6a,13-diaza-indeno[2,1-a]anthracene-11-carboxylic acid methyl ester methyl 19-methyl-16,17-didehydrooxayohimban-16-carboxylate oxayohimban-16-carboxylic acid, 16,17-didehydro-19-methyl-, methyl ester, (19alpha)- InChI=1/C21H24N2O3/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2/h3-6,11-12,15-16,19,22H,7-10H2,1-2H3/t12-,15?,16?,19?/m0/s1 GRTOGORTSDXSFK-PGVXHYKTBS (16E,19S)-17,19-Epoxy-coryn-16-ene-16-carboxylic acid methyl ester; δ-yohimbin (19α)-16,17-Didehydro-19-methyl-oxayohimban-16-carboxylic acid methyl ester (19S)-17,19-Epoxy-coryn-16-ene-16-carboxylic acid methyl ester 19α-Methyl-18-oxa-yohimb-16-ene-16-carboxylic acid methyl ester Ajmalicine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(12E,22E,24Z)-6,10,18,20-tetrahydroxy-1'-isobutyl-14-methoxy-7,9,15,17,19,21,25-heptamethyl-5,26-dioxo-3,5,9,10-tetrahydrospiro[9,4-(epoxypentadeca[1,11,13]trienoimino)furo[2',3':7,8]naphtho[1,2-d]imi InChI=1/C46H64N4O11/c1-22(2)21-50-18-16-46(17-19-50)48-34-31-32-39(54)28(8)42-33(31)43(56)45(10,61-42)59-20-15-30(58-11)25(5)41(60-29(9)51)27(7)38(53)26(6)37(52)23(3)13-12-14-24(4)44(57)47-36(40(32)55)35(34)49-46/h12-15,20,22-23,25-27,30,37-38,41,43,49,5 SHEFAUYIXSFJFF-NEDZDATGBK 4-deoxy-3,4-[2-spiro-(N-isobutyl-4-piperidyl)]imidazo-(2,5-dihydro)-11-hydroxyrifamycin S rifabutinol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-allyloxy-indan-1-one 6-(allyloxy)indan-1-one 1H-inden-1-one, 2,3-dihydro-6-(2-propenyloxy)- InChI=1/C12H12O2/c1-2-7-14-10-5-3-9-4-6-12(13)11(9)8-10/h2-3,5,8H,1,4,6-7H2 QWRWXXQGESYKNJ-UHFFFAOYAQ 6-allyloxy-indan-1-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,3,7-Trihydroxy-6-methoxy-4,5-bis-(3-methyl-but-2-enyl)-xanthen-9-one 1,3,7-trihydroxy-6-methoxy-4,5-bis(3-methylbut-2-en-1-yl)-9H-xanthen-9-one 9H-xanthen-9-one, 1,3,7-trihydroxy-6-methoxy-4,5-bis(3-methyl-2-butenyl)- InChI=1/C24H26O6/c1-12(2)6-8-14-17(25)11-18(26)20-21(28)16-10-19(27)23(29-5)15(9-7-13(3)4)22(16)30-24(14)20/h6-7,10-11,25-27H,8-9H2,1-5H3 CJBZJZGULKATPY-UHFFFAOYAP 1,3,7-Trihydroxy-6-methoxy-4,5-diisoprenylxanthone Cratoxyarborenone E . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,4a,7,7,10a-Pentamethyl-3-vinyl-dodecahydro-benzo[f]chromene-6,9-diol rel-(3R,4aS,6R,9R,10aR,10bS)-3,4a,7,7,10a-pentamethyl-3-vinyldodecahydro-1H-benzo[f]chromene-6,9-diol 1H-naphtho[2,1-b]pyran-6,9-diol, 3-ethenyldodecahydro-3,4a,7,7,10a-pentamethyl-, (3R,4aS,6R,9R,10aR,10bS)- InChI=1/C20H34O3/c1-7-18(4)9-8-15-19(5)11-13(21)10-17(2,3)16(19)14(22)12-20(15,6)23-18/h7,13-16,21-22H,1,8-12H2,2-6H3/t13-,14-,15+,16?,18+,19+,20+/m1/s1 RKOISLZDTLWETB-BQTRZHDPBV 2β,6β-Dihydroxy-ent-13-epi-manoyl oxide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1,4,7-Trihydroxy-3,9-dimethoxy-benzo[c]chromen-6-one 1,4,7-trihydroxy-3,9-dimethoxy-6H-benzo[c]chromen-6-one 6H-dibenzo[b,d]pyran-6-one, 1,4,7-trihydroxy-3,9-dimethoxy- InChI=1/C15H12O7/c1-20-6-3-7-11-9(17)5-10(21-2)13(18)14(11)22-15(19)12(7)8(16)4-6/h3-5,16-18H,1-2H3 VYZSKNNGIBILKL-UHFFFAOYAE Graphislactone E . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
N-(7-sec-Butyl-5,8-dioxo-3-phenyl-2-oxa-6,9-diaza-bicyclo[10.2.2]hexadeca-1(15),10,12(16),13-tetraen-4-yl)-2-methylamino-3-phenyl-propionamide rel-(2R)-2-(methylamino)-N-[(3S,4R,7R,10Z)-7-[(1R)-1-methylpropyl]-5,8-dioxo-3-phenyl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),10,12,15-tetraen-4-yl]-3-phenylpropanamide benzenepropanamide, alpha-(methylamino)-N-[(3R,4S,7S,10Z)-7-[(1S)-1-methylpropyl]-5,8-dioxo-3-phenyl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-10,12,14,15-tetraen-4-yl]-, (alphaS)- InChI=1/C33H38N4O4/c1-4-22(2)28-32(39)35-20-19-23-15-17-26(18-16-23)41-30(25-13-9-6-10-14-25)29(33(40)36-28)37-31(38)27(34-3)21-24-11-7-5-8-12-24/h5-20,22,27-30,34H,4,21H2,1-3H3,(H,35,39)(H,36,40)(H,37,38)/b20-19-/t22-,27-,28-,29-,30+/m0/s1 JDFUVCMEHULMNF-RMWVGYOZBH Condaline-A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(3,4-Dihydroxy-2,5-bis-hydroxymethyl-tetrahydro-furan-2-yloxy)-3-methyl-butane-1,2,3-triol (2R,3S)-2,3,4-trihydroxy-2-methylbutyl rel-hex-2-ulofuranoside 2-hexulofuranoside, (2S,3R)-2,3,4-trihydroxy-2-methylbutyl InChI=1/C11H22O9/c1-10(18,7(15)3-13)5-19-11(4-14)9(17)8(16)6(2-12)20-11/h6-9,12-18H,2-5H2,1H3/t6?,7-,8?,9?,10+,11?/m1/s1 RROOHAHINGDEJR-IENWSFKZBX 2-C-Methyl-D-erythritol 1-O-β-D-fructofuranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Methyl-6-propoxy-pyrazine 2-methyl-6-propoxypyrazine pyrazine, 2-methyl-6-propoxy- InChI=1/C8H12N2O/c1-3-4-11-8-6-9-5-7(2)10-8/h5-6H,3-4H2,1-2H3 RSYNIAMYGDKFMO-UHFFFAOYAJ 2-Methyl-6-propoxy-pyrazine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-(1-Hydroxy-1-methyl-ethyl)-4-methyl-8-methylene-octahydro-2,4-methano-indene-1,3-diol rel-(1R,3aS,4R,7S,7aR)-7-(1-hydroxy-1-methylethyl)-4-methyl-8-methyleneoctahydro-1H-2,4-methanoindene-1,3-diol 2,4-methano-1H-indene-1,3-diol, octahydro-7-(1-hydroxy-1-methylethyl)-4-methyl-8-methylene-, (1R,3aS,4R,7S,7aR)- InChI=1/C15H24O3/c1-7-9-12(16)10-8(14(2,3)18)5-6-15(7,4)11(10)13(9)17/h8-13,16-18H,1,5-6H2,2-4H3/t8-,9?,10-,11+,12-,13?,15-/m0/s1 ZAMMUPBTBWXWKL-WQOUDKNTBU Isosativenetriol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Malonic acid mono-[6-[5,7-dihydroxy-2-(4-hydroxy-phenyl)-4-oxo-4H-chromen-3-yloxy]-3,4-dihydroxy-5-(3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-tetrahydro-pyran-2-ylmethyl] ester 5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl 6-O-(carboxyacetyl)-2-O-(6-deoxyhexopyranosyl)hexopyranoside hexopyranoside, 5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-3-yl 2-O-(6-deoxyhexopyranosyl)-, 6-(2-carboxyacetate) InChI=1/C30H32O18/c1-10-20(37)23(40)25(42)29(44-10)48-28-24(41)21(38)16(9-43-18(36)8-17(34)35)46-30(28)47-27-22(39)19-14(33)6-13(32)7-15(19)45-26(27)11-2-4-12(31)5-3-11/h2-7,10,16,20-21,23-25,28-33,37-38,40-42H,8-9H2,1H3,(H,34,35) JTOOPMHFLOLUPJ-UHFFFAOYAC Kaempferol 3-O-(2''-O-α-rhamnosyl-6''-O-malonyl)-β-glucoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-bromo-3a-(1,1-dimethyl-allyl)-1-methyl-8-(3-methyl-but-2-enyl)-1,2,3,3a,8,8a-hexahydro-pyrrolo[2,3-b]indole rel-(3aR,8aR)-6-bromo-3a-(1,1-dimethylprop-2-en-1-yl)-1-methyl-8-(3-methylbut-2-en-1-yl)-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole pyrrolo[2,3-b]indole, 6-bromo-3a-(1,1-dimethyl-2-propenyl)-1,2,3,3a,8,8a-hexahydro-1-methyl-8-(3-methyl-2-butenyl)-, (3aR,8aR)- InChI=1/C21H29BrN2/c1-7-20(4,5)21-11-13-23(6)19(21)24(12-10-15(2)3)18-14-16(22)8-9-17(18)21/h7-10,14,19H,1,11-13H2,2-6H3/t19-,21-/m1/s1 AJYIZQUARKFPEC-TZIWHRDSBG 6-bromo-1-methyl-3a-(1,1-dimethyl-allyl)-8-(3-methyl-but-2-enyl)-1,2,3,3a,8,8a-hexahydro-pyrrolo[2,3-b]indole Flustramine A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(2-isopropyl-5-methyl-cyclohex-1-enylselanyl)-benzene [(2-isopropyl-5-methylcyclohex-1-en-1-yl)seleno]benzene benzene, [[(5S)-5-methyl-2-(1-methylethyl)-1-cyclohexen-1-yl]seleno]- InChI=1/C16H22Se/c1-12(2)15-10-9-13(3)11-16(15)17-14-7-5-4-6-8-14/h4-8,12-13H,9-11H2,1-3H3/t13-/m0/s1 FOLNFOIMKSCWDC-ZDUSSCGKBJ 1-phenylselenenylmenthene phenylselenenylmenth-1-(2)-ene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-[4-Hydroxy-5-(4-hydroxy-3-methoxy-benzyl)-tetrahydro-furan-2-yl]-1-(4-hydroxy-3-methoxy-phenyl)-ethanone 3,6-anhydro-2,4,7-trideoxy-1,7-bis(4-hydroxy-3-methoxyphenyl)-xylo-heptose D-xylo-heptose, 3,6-anhydro-2,4,7-trideoxy-1,7-bis(4-hydroxy-3-methoxyphenyl)- InChI=1/C21H24O7/c1-26-19-7-12(3-5-15(19)22)8-21-18(25)11-14(28-21)10-17(24)13-4-6-16(23)20(9-13)27-2/h3-7,9,14,18,21-23,25H,8,10-11H2,1-2H3/t14-,18+,21+/m0/s1 LAISPMSUAQZCQJ-FIKMYACPBQ Renealtin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(3alpha,5beta,6beta,8alpha,9beta,10alpha)-3,20-epoxykaur-16-ene-3,6-diol 9H-furo[3,2-b][1]benzopyran-9-one, 2,3,3a,9a-tetrahydro-8,9a-dihydroxy-6-methoxy-3a-(4-methoxyphenyl)-2-[(E)-2-(2,4,5-trimethoxyphenyl)ethenyl]-, (2S,3aR,9aR)- InChI=1/C20H30O3/c1-12-8-18-9-13(12)4-5-15(18)19-6-7-20(22,23-11-19)17(2,3)16(19)14(21)10-18/h13-16,21-22H,1,4-11H2,2-3H3/t13?,14-,15-,16-,18-,19-,20-/m1/s1 IZKLRFJACWWWBZ-HKIYEZBDBF Agallochin F ent-3β,20-Epoxy-3α,6α-dihydroxykaur-16-ene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
10,20-Dimethyl-5,15-bis-(2-methyl-cyclopropyl)-9,19-bis-(3,4,5-trimethoxy-tetrahydro-pyran-2-yloxy)-4,14,21,22-tetraoxa-tricyclo[15.3.1.1^7,11]docosane-3,13-dione rel-(1R,5R,7R,9R,10R,11R,15R,17R,19R,20R)-10,20-dimethyl-5,15-bis[(1R,2R)-2-methylcyclopropyl]-9,19-bis{[(2R,3S,4R,5S)-3,4,5-trimethoxytetrahydro-2H-pyran-2-yl]oxy}-4,14,21,22-tetraoxatricyclo[15.3.1. InChI=1/C44H72O16/c1-21-11-27(21)33-15-25-13-29(59-43-41(51-9)39(49-7)35(47-5)19-53-43)23(3)32(55-25)18-38(46)58-34(28-12-22(28)2)16-26-14-30(24(4)31(56-26)17-37(45)57-33)60-44-42(52-10)40(50-8)36(48-6)20-54-44/h21-36,39-44H,11-20H2,1-10H3/t21-,22-,23+,2 CTMDQMUAHLSXCW-GMJYCCEUBU Clavosolide A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
8,9a-Dihydroxy-6-methoxy-3a-(4-methoxy-phenyl)-2-[2-(2,4,5-trimethoxy-phenyl)-vinyl]-2,3,3a,9a-tetrahydro-1,4-dioxa-cyclopenta[b]naphthalen-9-one rel-(2R,3aS,9aS)-8,9a-dihydroxy-6-methoxy-3a-(4-methoxyphenyl)-2-[(E)-2-(2,4,5-trimethoxyphenyl)vinyl]-2,3,3a,9a-tetrahydro-9H-furo[3,2-b]chromen-9-one 9H-furo[3,2-b][1]benzopyran-9-one, 2,3,3a,9a-tetrahydro-8,9a-dihydroxy-6-methoxy-3a-(4-methoxyphenyl)-2-[(E)-2-(2,4,5-trimethoxyphenyl)ethenyl]-, (2S,3aR,9aR)- InChI=1/C30H30O10/c1-34-19-10-7-18(8-11-19)29-16-20(9-6-17-12-24(37-4)25(38-5)15-23(17)36-3)39-30(29,33)28(32)27-22(31)13-21(35-2)14-26(27)40-29/h6-15,20,31,33H,16H2,1-5H3/b9-6+/t20-,29-,30+/m1/s1 IZGFFJPOYHFVMH-PUMFUAEBBI rel-5-Hydroxy-7,4'-dimethoxy-2''S-(2,4,5-trimethoxy-E-styryl)tetrahydrofuro[4''R,5''R:2,3]flavanonol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-(4-Hydroxy-3,5-dimethoxy-phenyl)-acrylic acid 3a-hydroxymethyl-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-icosahydro-cyclopenta[a]chrysen-9-yl ester (3beta)-28-hydroxylup-20(29)-en-3-yl (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylate 2-propenoic acid, 3-(4-hydroxy-3,5-dimethoxyphenyl)-, (3beta)-28-hydroxylup-20(29)-en-3-yl ester, (2E)- InChI=1/C41H60O6/c1-25(2)27-14-19-41(24-42)21-20-39(6)28(35(27)41)11-12-32-38(5)17-16-33(37(3,4)31(38)15-18-40(32,39)7)47-34(43)13-10-26-22-29(45-8)36(44)30(23-26)46-9/h10,13,22-23,27-28,31-33,35,42,44H,1,11-12,14-21,24H2,2-9H3/b13-10+/t27-,28+,31-,32+,3 FDSGBLWAYGFDTJ-XTAFKLMRBH 3β-trans-Sinapoyloxylup-20(29)-en-28-ol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
17-(1-Methoxy-ethylidene)-10,13-dimethyl-1,6,7,8,9,10,11,12,13,14,15,17-dodecahydro-2H-cyclopenta[a]phenanthrene-3,16-dione (8xi,9xi,14xi,17E)-20-methoxypregna-4,17-diene-3,16-dione pregna-4,17-diene-3,16-dione, 20-methoxy-, (8xi,9xi,14xi,17E)- InChI=1/C22H30O3/c1-13(25-4)20-19(24)12-18-16-6-5-14-11-15(23)7-9-21(14,2)17(16)8-10-22(18,20)3/h11,16-18H,5-10,12H2,1-4H3/b20-13-/t16?,17?,18?,21-,22-/m0/s1 WOVLRQSWILBDQL-HVFOMWKBBT 20-Methoxy-4,17(20)E-pregnadiene-3,16-dione Guggulsterone-M . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
N-methoxy-benzimidic acid methyl ester methyl N-methoxybenzenecarboximidoate benzenecarboximidic acid, N-methoxy-, methyl ester InChI=1/C9H11NO2/c1-11-9(10-12-2)8-6-4-3-5-7-8/h3-7H,1-2H3/b10-9- WSIGXRHBRQYGEI-KTKRTIGZBF (Z)-Methyl N-methoxybenzoximidate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(5-hydroxy-3,4,4,5-tetramethyl-4,5-dihydro-pyrazol-1-yl)-p-tolyl-methanone 3,4,4,5-tetramethyl-1-(4-methylbenzoyl)-4,5-dihydro-1H-pyrazol-5-ol 1H-pyrazol-5-ol, 4,5-dihydro-3,4,4,5-tetramethyl-1-(4-methylbenzoyl)-, (5R)- InChI=1/C15H20N2O2/c1-10-6-8-12(9-7-10)13(18)17-15(5,19)14(3,4)11(2)16-17/h6-9,19H,1-5H3/t15-/m1/s1 YXIBPSMKHVALOY-OAHLLOKOBX 1-(p-methylbenzoyl)-5-hydroxy-3,4,4,5-tetramethyl-2-pyrazoline 5-hydroxy-1-(4'-methylbenzoyl)-3,4,4,5-tetramethyl-4,5-dihydro-1H-pyrazole . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2,8-Dimethyl-6H,12H-5,11-methano-dibenzo[b,f][1,5]diazocine 2,8-dimethyl-6H,12H-5,11-methanodibenzo[b,f][1,5]diazocine 6H,12H-5,11-methanodibenzo[b,f][1,5]diazocine, 2,8-dimethyl- InChI=1/C17H18N2/c1-12-3-5-16-14(7-12)9-18-11-19(16)10-15-8-13(2)4-6-17(15)18/h3-8H,9-11H2,1-2H3 SXPSZIHEWFTLEQ-UHFFFAOYAW (±)-2,8-Dimethyl-6H,12H-5,11-methanodibenzo[b,f][1,5]diazocine 2,8-Dimethyl-6H,12H-5,11-methano-dibenzo[b,f][1,5]diazocine Tröger's base . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(3beta,5beta,8xi,9xi,16beta)-16-(acetyloxy)-3-{[beta-D-glucopyranosyl-(1->4)-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl]oxy}-14-hydroxycard-20(22 card-20(22)-enolide, 16-(acetyloxy)-3-[[O-beta-D-glucopyranosyl-(1->4)-O-2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl]oxy]-14-hydroxy-, (3beta,5beta,8x InChI=1/C44H68O17/c1-20-39(60-34-16-29(53-6)40(21(2)56-34)61-41-38(51)37(50)36(49)31(18-45)59-41)28(47)15-33(55-20)58-25-9-11-42(4)24(14-25)7-8-27-26(42)10-12-43(5)35(23-13-32(48)54-19-23)30(57-22(3)46)17-44(27,43)52/h13,20-21,24-31,33-41,45,47,49-52H,7- SGGQTRPBTCNENJ-XYQZPUSVBO Cryptostigmin I Oleandrigenin 3-O-β-glucopyranosyl-(1→4)-β-cymaropyranosyl-(1→4)-β-digitoxopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,7-Dihydroxy-8-(2-hydroxy-3-methyl-but-3-enyl)-6-(2-methyl-butyryl)-4-propyl-chromen-2-one 5,7-dihydroxy-8-(2-hydroxy-3-methylbut-3-en-1-yl)-6-(2-methylbutanoyl)-4-propyl-2H-chromen-2-one 2H-1-benzopyran-2-one, 5,7-dihydroxy-8-(2-hydroxy-3-methyl-3-butenyl)-6-(2-methyl-1-oxobutyl)-4-propyl- InChI=1/C22H28O6/c1-6-8-13-9-16(24)28-22-14(10-15(23)11(3)4)20(26)18(21(27)17(13)22)19(25)12(5)7-2/h9,12,15,23,26-27H,3,6-8,10H2,1-2,4-5H3 LMOOLBWPPNMVJY-UHFFFAOYAZ 5,7-Dihydroxy-8-(2-hydroxy-3-methylbut-3-enyl)-6-(2-methyl-1-oxobutyl)-4-propyl-2H-[1]benzopyran-2-one Disparpropylinol B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7,8-Dimethoxy-9,10-dihydro-phenanthrene-2,4,6-triol 7,8-dimethoxy-9,10-dihydrophenanthrene-2,4,6-triol 2,4,6-phenanthrenetriol, 9,10-dihydro-7,8-dimethoxy- InChI=1/C16H16O5/c1-20-15-10-4-3-8-5-9(17)6-12(18)14(8)11(10)7-13(19)16(15)21-2/h5-7,17-19H,3-4H2,1-2H3 MMXRNRQNOAKVBD-UHFFFAOYAN 3,5,7-Trihydroxy-1,2-dimethoxy-9,10-dihydrophenanthrene Coeloginanthridin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-(4-Hydroxy-benzyl)-5-[2-(4-hydroxy-3-methoxy-phenyl)-vinyl]-benzene-1,3-diol 4-(4-hydroxybenzyl)-5-[(E)-2-(4-hydroxy-3-methoxyphenyl)vinyl]benzene-1,3-diol 1,3-benzenediol, 5-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]-4-[(4-hydroxyphenyl)methyl]- InChI=1/C22H20O5/c1-27-22-11-15(5-9-20(22)25)2-6-16-12-18(24)13-21(26)19(16)10-14-3-7-17(23)8-4-14/h2-9,11-13,23-26H,10H2,1H3/b6-2+ VFHNCULLCMIZKI-QHHAFSJGBJ 10-(4-Hydroxybenzyl)-isorhapontigenin Gnetupendin A . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-Hydroxy-6-(4-hydroxy-phenyl)-2-isopropenyl-2,3-dihydro-furo[3,2-g]chromen-5-one 4-hydroxy-6-(4-hydroxyphenyl)-2-isopropenyl-2,3-dihydro-5H-furo[3,2-g]chromen-5-one 5H-furo[3,2-g][1]benzopyran-5-one, 2,3-dihydro-4-hydroxy-6-(4-hydroxyphenyl)-2-(1-methylethenyl)-, (2R)- InChI=1/C20H16O5/c1-10(2)15-7-13-16(25-15)8-17-18(19(13)22)20(23)14(9-24-17)11-3-5-12(21)6-4-11/h3-6,8-9,15,21-22H,1,7H2,2H3/t15-/m1/s1 CQXOSSCKEFRIBR-OAHLLOKOBQ 5''-(S)-5,4'-Dihydroxy-5''-isopropenyl-4'',5''-dihydrofurano[2'',3'':6,7]isoflavone Licoagroisoflavone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Methoxy-5H-4-oxa-pyrene-2,7-diol 6-methoxy-5H-naphtho[8,1,2-cde]chromene-2,7-diol 5H-phenanthro[4,5-bcd]pyran-2,7-diol, 6-methoxy- InChI=1/C16H12O4/c1-19-16-11-7-20-13-6-10(17)4-8-2-3-9(5-12(16)18)14(11)15(8)13/h2-6,17-18H,7H2,1H3 SBFGLQBYWJJLEG-UHFFFAOYAO 3-Methoxy-2,7-dihydroxy-5H-phenanthro[4,5-bcd]pyran . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(19alpha)-11-(3-ethyl-8-methoxy-12H-indolo[2,3-a]quinolizin-5-ium-2-yl)-19-methyl-10,11-didehydrostrychnidin-19-ium strychnidin-19-ium, 10,11-didehydro-11-(3-ethyl-8-methoxy-12H-indolo[2,3-a]quinolizin-5-ium-2-yl)-19-methyl-, (19alpha)- InChI=1/C40H39N4O2/c1-4-23-20-42-15-12-25-35-30(9-7-11-33(35)45-3)41-37(25)32(42)18-26(23)28-21-43-31-10-6-5-8-29(31)40-14-16-44(2)22-24-13-17-46-38(28)36(39(40)43)27(24)19-34(40)44/h5-13,15,18,20-21,27,34,36,38-39H,4,14,16-17,19,22H2,1-3H3/q+1/p+1/t27-, YPRVNVFJGQUFKN-IXEHLPFXBH 5',6'-Dehydroguiaflavine . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-[2-(2-Hydroxymethyl-3-methoxy-phenyl)-vinyl]-5-methyl-tetrahydro-furan-3,4-diol (1E)-3,6-anhydro-1,2,7-trideoxy-1-[2-(hydroxymethyl)-3-methoxyphenyl]-allo-hept-1-enitol D-allo-hept-6-enitol, 2,5-anhydro-1,6,7-trideoxy-7-[2-(hydroxymethyl)-3-methoxyphenyl]-, (6E)- InChI=1/C15H20O5/c1-9-14(17)15(18)13(20-9)7-6-10-4-3-5-12(19-2)11(10)8-16/h3-7,9,13-18H,8H2,1-2H3/b7-6+/t9-,13+,14-,15+/m0/s1 JGUADRHIBCXAFH-XAUFSTHIBI (3'R*,4'R*,5'S*,6'S*)-2-Methoxy-6-(3',6'-epoxy-4',5'-dihydroxyheptenyl)benzyl alcohol Varitriol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4-[4-(4-Amino-phenoxy)-phenyl]-2-(4-amino-phenyl)-2H-phthalazin-1-one 4-[4-(4-aminophenoxy)phenyl]-2-(4-aminophenyl)phthalazin-1(2H)-one 1(2H)-phthalazinone, 4-[4-(4-aminophenoxy)phenyl]-2-(4-aminophenyl)- InChI=1/C26H20N4O2/c27-18-7-11-20(12-8-18)30-26(31)24-4-2-1-3-23(24)25(29-30)17-5-13-21(14-6-17)32-22-15-9-19(28)10-16-22/h1-16H,27-28H2 RGAUDZCZLUZPOR-UHFFFAOYAR 1,2-Dihydro-2-(4-aminophenyl)-4-[4-(4-aminophenoxy)-4-phenyl]-(2H)-phthalazin-1-one Phthalazinone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Methyl-1,2,7,8-tetrahydro-3-oxa-as-indacen-6-one 2-methyl-1,2,7,8-tetrahydro-6H-indeno[5,4-b]furan-6-one 6H-indeno[5,4-b]furan-6-one, 1,2,7,8-tetrahydro-2-methyl- InChI=1/C12H12O2/c1-7-6-10-8-2-4-11(13)9(8)3-5-12(10)14-7/h3,5,7H,2,4,6H2,1H3 JJOIDNLJGABWHY-UHFFFAOYAB 2-Methyl-2,3-dihydrofuro-indanone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
4,4'-methylenediphenol phenol, 4,4'-methylenebis- InChI=1/C13H12O2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h1-8,14-15H,9H2 PXKLMJQFEQBVLD-UHFFFAOYAW 4,4'-Dihydroxydiphenylmethane 4,4'-methanediyl-di-phenol 4,4'-methylenebis-phenol bis(4-hydroxyphenyl)methane . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
7-[(6-deoxyhexopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-3-yl 6-deoxyhexopyranosyl-(1->2)-[6-deoxyhexopyranosyl-(1->6)]hexopyranoside 4H-1-benzopyran-4-one, 3-[[O--6-deoxyhexopyranosyl-(1->2)-O-[6-deoxyhexopyranosyl-(1->6)]hexopyranosyl]oxy]-7-[(6-deoxyhexopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy- InChI=1/C39H50O24/c1-10-21(43)26(48)30(52)36(56-10)55-9-19-24(46)29(51)35(63-38-32(54)28(50)23(45)12(3)58-38)39(61-19)62-34-25(47)20-17(42)7-14(59-37-31(53)27(49)22(44)11(2)57-37)8-18(20)60-33(34)13-4-5-15(40)16(41)6-13/h4-8,10-12,19,21-24,26-32,35-46,48 NNQSUCKHVOROOX-UHFFFAOYAZ Quercetin 3-O-α-L-rhamnopyranosyl(1→6)-[α-L-rhamnopyranosyl(1→2)]-β-D-galactopyranoside-7-O-α-L-rhamnopyranoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3-[8,14,24-Tris-carbamoylmethyl-11-(4-hydroxy-benzyl)-21-hydroxymethyl-4,7,10,13,16,20,23,26-octaoxo-18-undecyl-hexacosahydro-3a,6,9,12,15,19,22,25-octaaza-cyclopentacyclopentacosen-5-yl]-propionamide 3-[3,13,19-tris(2-amino-2-oxoethyl)-16-(4-hydroxybenzyl)-6-(hydroxymethyl)-1,4,7,11,14,17,20,23-octaoxo-9-undecylhexacosahydro-1H-pyrrolo[2,1-i][1,4,7,10,13,16,19,22]octaazacyclopentacosin-22-yl]propa benzene, 1-fluoro-2,4-dinitro- InChI=1/C48H74N12O14/c1-2-3-4-5-6-7-8-9-10-12-28-22-41(67)54-32(23-38(50)64)43(69)56-31(21-27-14-16-29(62)17-15-27)42(68)57-33(24-39(51)65)44(70)55-30(18-19-37(49)63)48(74)60-20-11-13-36(60)47(73)58-34(25-40(52)66)45(71)59-35(26-61)46(72)53-28/h14-17,28, HNAPWDKFUSLFFE-UHFFFAOYAR Iturin A-2 . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-fluoro-2,4-dinitro-benzene 1-fluoro-2,4-dinitrobenzene benzene, 1-fluoro-2,4-dinitro- InChI=1/C6H3FN2O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H LOTKRQAVGJMPNV-UHFFFAOYAZ 1-fluoro-2,4-dinitro-benzene 2,4-dinitrofluorobenzene FDNB Sanger's Reagent . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 10,13-dimethyl-17-(6-oxo-6H-pyran-3-yl)-3-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-hexadecahydro-20-oxa-cyclopropa[14,15]cyclopenta[a]phenanthren-16-yl ester (3beta,8xi,9xi,15beta,16beta)-16-(acetyloxy)-3-(hexopyranosyloxy)-14,15-epoxybufa-20,22-dienolide bufa-20,22-dienolide, 16-(acetyloxy)-14,15-epoxy-3-(hexopyranosyloxy)-, (3beta,8xi,9xi,15beta,16beta)- InChI=1/C32H44O11/c1-15(34)40-27-23(16-4-7-22(35)39-14-16)31(3)11-9-19-20(32(31)28(27)43-32)6-5-17-12-18(8-10-30(17,19)2)41-29-26(38)25(37)24(36)21(13-33)42-29/h4,7,14,17-21,23-29,33,36-38H,5-6,8-13H2,1-3H3/t17?,18-,19?,20?,21?,23-,24?,25?,26?,27+,28+,29 LTFQQGPJNXCYAC-QSTDQKOSBJ Cinobufagin 3-O-β-D-glucoside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5,7-Dihydroxy-3-[4-methoxy-3-(3-methyl-but-2-enyl)-phenyl]-6-(3-methyl-but-2-enyl)-chroman-4-one 5,7-dihydroxy-3-[4-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-6-(3-methylbut-2-en-1-yl)-2,3-dihydro-4H-chromen-4-one 4H-1-benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-3-[4-methoxy-3-(3-methyl-2-butenyl)phenyl]-6-(3-methyl-2-butenyl)-, (3R)- InChI=1/C26H30O5/c1-15(2)6-8-18-12-17(9-11-22(18)30-5)20-14-31-23-13-21(27)19(10-7-16(3)4)25(28)24(23)26(20)29/h6-7,9,11-13,20,27-28H,8,10,14H2,1-5H3/t20-/m0/s1 NYKUNEKGAYOKPN-FQEVSTJZBL (3R)-5,7-dihydroxy-4'-methoxy-6,3'-di(3-methylbut-2-enyl)isoflavone Vogelin D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
9-Amino-4-hydroxy-12-isobutyl-10,13-dioxo-2-oxa-11,14-diaza-tricyclo[15.2.2.1^(3,7)]docosa-1(20),3,5,7(22),17(21),18-hexaene-15-carboxylic acid rel-(9R,12R,15R)-9-amino-4-hydroxy-12-isobutyl-10,13-dioxo-2-oxa-11,14-diazatricyclo[15.2.2.1~3,7~]docosa-1(19),3(22),4,6,17,20-hexaene-15-carboxylic acid 2-oxa-11,14-diazatricyclo[15.2.2.1~3,7~]docosa-3,5,7(22),17,19,20-hexaene-15-carboxylic acid, 9-amino-4-hydroxy-12-(2-methylpropyl)-10,13-dioxo-, (9S,12S,15S)- InChI=1/C24H29N3O6/c1-13(2)9-18-23(30)27-19(24(31)32)11-14-3-6-16(7-4-14)33-21-12-15(5-8-20(21)28)10-17(25)22(29)26-18/h3-8,12-13,17-19,28H,9-11,25H2,1-2H3,(H,26,29)(H,27,30)(H,31,32)/t17-,18-,19-/m0/s1 DMMMOFGVDNJQPZ-FHWLQOOXBK Renieramide . Information we have got: NMR spectra 13C, 13C, 3D coordinates, File formats: CML, mol, png, jpeg
methyl rel-(2E)-3-[(1R,2S,5R,7S,9R,11S,12S,13R,14R,15S,16R,17S)-12-formyl-14,15-dihydroxy-7,16-dimethyl-6,8,20,23-tetraoxaheptacyclo[15.3.2.1~5,9~.1~7,11~.0~1,16~.0~2,13~.0~5,12~]tetracos-18-en-18-yl] 10H-oxireno[5,6][2]benzopyrano[4,3-c]quinolin-10-one, 11-[(acetyloxy)methyl]-6,6a,7,8,8a,9a,9b,11-octahydro-6,6,8a-trimethyl-, (6aS,8aR,9aS,9bS)- InChI=1/C27H34O9/c1-23-16-7-9-27(23,33-12-14(16)4-5-19(29)32-3)17-6-8-25-11-15-10-18(35-24(2,34-15)36-25)26(25,13-28)20(17)21(30)22(23)31/h4-5,12-13,15-18,20-22,30-31H,6-11H2,1-3H3/b5-4+/t15-,16+,17+,18+,20+,21-,22-,23-,24+,25-,26+,27-/m0/s1 ITDCKIJSDFBBAV-GUOQTXSDBB Methyl daigremonate Methyl [1β,3β,5β,11α,12α]-(22E)-1,3,5-ethylidynetris(oxy)-14,21-epoxy-11,12-dihydroxy-19-oxo-5β,14β-chola-20,22-dien-24-oate . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 2a,11,11-trimethyl-4-oxo-2,2a,3a,3b,11,11a-hexahydro-1H,4H-3,10-dioxa-5-aza-cyclopropa[c]chrysen-5-ylmethyl ester [(6aR,8aS,9aR,9bR)-6,6,8a-trimethyl-10-oxo-6a,7,8,8a,9a,9b-hexahydro-6H-oxireno[5,6]isochromeno[4,3-c]quinolin-11(10H)-yl]methyl rel-acetate 10H-oxireno[5,6][2]benzopyrano[4,3-c]quinolin-10-one, 11-[(acetyloxy)methyl]-6,6a,7,8,8a,9a,9b,11-octahydro-6,6,8a-trimethyl-, (6aS,8aR,9aS,9bS)- InChI=1/C22H25NO5/c1-12(24)26-11-23-15-8-6-5-7-13(15)18-17(20(23)25)16-14(21(2,3)27-18)9-10-22(4)19(16)28-22/h5-8,14,16,19H,9-11H2,1-4H3/t14-,16-,19-,22+/m0/s1 HUTWRNCECFUQMQ-WAXYGOQGBC trans-Erioaustralasine {rel}-1-Acetoxymethyl-4,8'-epoxy-3-(1'β,2'β-epoxy-3'β,4'α-para-menthyl-3'-yl)quinolin-2-one . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(3R,3aR,5aS,5bR,6S,7aS,11aR,11bR,13aS,13bR)-5b-hydroxy-3-isopropyl-3a,5a,8,8,13a-pentamethylicosahydro-6,11a-(epoxymethano)cyclopenta[a]chrysen-14-one 6,11a-(epoxymethano)-11aH-cyclopenta[a]chrysen-14-one, eicosahydro-5b-hydroxy-3a,5a,8,8,13a-pentamethyl-3-(1-methylethyl)-, (3R,3aR,5aS,5bR,6S,7aS,11aR,11bR,13aS,13bR)- InChI=1/C30H48O3/c1-18(2)19-9-10-20-26(19,5)15-16-28(7)27(20,6)14-11-21-29-13-8-12-25(3,4)22(29)17-23(30(21,28)32)33-24(29)31/h18-23,32H,8-17H2,1-7H3/t19-,20-,21-,22+,23+,26-,27+,28+,29+,30+/m1/s1 AWKQCEWSSUBAJV-YWDAATOXBU 8α-Hydroxyfernan-25,7β-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,5,7-Trihydroxy-2-(2-hydroxy-phenyl)-6-methoxy-8-(3-methyl-but-2-enyl)-chroman-4-one rel-(2R,3S)-3,5,7-trihydroxy-2-(2-hydroxyphenyl)-6-methoxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-4H-chromen-4-one 4H-1-benzopyran-4-one, 2,3-dihydro-3,5,7-trihydroxy-2-(2-hydroxyphenyl)-6-methoxy-8-(3-methyl-2-butenyl)-, (2R,3R)- InChI=1/C21H22O7/c1-10(2)8-9-12-15(23)21(27-3)17(25)14-16(24)18(26)20(28-19(12)14)11-6-4-5-7-13(11)22/h4-8,18,20,22-23,25-26H,9H2,1-3H3/t18-,20-/m0/s1 XZNFAYXFFDZGJD-IJHRGXPZBP 3,5,7,2'-Tetrahydroxy-6-methoxy-8-prenylflavanone Floranol . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 5-chloromethyl-5-hydroxy-1,2-dimethyl-4-oxo-1-[2-(5-oxo-2,5-dihydro-furan-3-yl)-ethyl]-octahydro-naphthalen-4a-ylmethyl ester [(1R,2S,4aR,5S,8aS)-5-(chloromethyl)-5-hydroxy-1,2-dimethyl-4-oxo-1-[2-(5-oxo-2,5-dihydrofuran-3-yl)ethyl]octahydronaphthalen-4a(2H)-yl]methyl rel-acetate 2(5H)-furanone, 4-[2-[(1S,2R,4aS,5R,8aR)-4a-[(acetyloxy)methyl]-5-(chloromethyl)decahydro-5-hydroxy-1,2-dimethyl-4-oxo-1-naphthalenyl]ethyl]- InChI=1/C22H31ClO6/c1-14-9-18(25)22(13-29-15(2)24)17(5-4-7-21(22,27)12-23)20(14,3)8-6-16-10-19(26)28-11-16/h10,14,17,27H,4-9,11-13H2,1-3H3/t14-,17-,20+,21+,22+/m1/s1 CGDXZAMEJFCLBC-NPZIIBKFBO 19-Acetoxy-18-chloro-4α-hydroxy-6-oxoneoclerod-13-en-15,16-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
6-Oxo-6H-pyran-2,4-dicarboxylic acid 2-oxo-2H-pyran-4,6-dicarboxylic acid 2H-pyran-4,6-dicarboxylic acid, 2-oxo- InChI=1/C7H4O6/c8-5-2-3(6(9)10)1-4(13-5)7(11)12/h1-2H,(H,9,10)(H,11,12) VRMXCPVFSJVVCA-UHFFFAOYAO 2-Pyrone-4,6-dicarboxylic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(3beta,5xi)-30-hydroxy-30-oxolanosta-8,24-dien-3-yl pentopyranosyl-(1->3)hexopyranuronosyl-(1->4)hexopyranosiduronic acid lanosta-8,24-dien-30-oic acid, 3-[[O-pentopyranosyl-(1->3)-O-hexopyranuronosyl-(1->4)hexopyranuronosyl]oxy]-, (3beta,5xi)- InChI=1/C47H72O19/c1-20(2)9-8-10-21(3)22-14-18-47(43(59)60)24-11-12-26-44(4,5)27(15-16-45(26,6)23(24)13-17-46(22,47)7)62-41-31(52)29(50)35(37(66-41)39(57)58)64-42-33(54)34(32(53)36(65-42)38(55)56)63-40-30(51)28(49)25(48)19-61-40/h9,21-22,25-37,40-42,48-5 YPXXUUWXJGOZRF-JDAULCBMBY Nobiloside . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(5alpha,8alpha)-4,4,14-trimethyl-8,9-epoxypregnane-3,7,11,15,20-pentone pregnane-3,7,11,15,20-pentone, 8,9-epoxy-4,4,14-trimethyl-, (5alpha,8alpha)- InChI=1/C24H30O6/c1-12(25)13-9-16(27)22(6)21(13,5)11-18(29)23-20(4)8-7-15(26)19(2,3)14(20)10-17(28)24(22,23)30-23/h13-14H,7-11H2,1-6H3/t13-,14+,20+,21-,22-,23+,24+/m1/s1 NZNMCSYRDNCBPL-BNAOJXJXBB 8α,9α-Epoxy-4,4,14α-trimethyl-3,7,11,15,20-pentaoxo-5α-pregnane . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Bromo-1,1,9-trimethyl-5-methylene-spiro[5.5]undec-8-en-3-ol rel-(2R,3S,6R)-2-bromo-1,1,9-trimethyl-5-methylenespiro[5.5]undec-8-en-3-ol spiro[5.5]undec-8-en-3-ol, 2-bromo-1,1,9-trimethyl-5-methylene-, (2S,3R,6S)- InChI=1/C15H23BrO/c1-10-5-7-15(8-6-10)11(2)9-12(17)13(16)14(15,3)4/h5,12-13,17H,2,6-9H2,1,3-4H3/t12-,13-,15-/m1/s1 APALGGYWOOAWLG-UMVBOHGHBF (6R,9R,10S)-10-Bromo-9-hydroxy-chamigra-2,7(14)-diene . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
3,N-Dihydroxy-3-(4-hydroxy-phenyl)-thiopropionimidic acid 3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yl ester rel-1-R-[(1Z,3S)-N,3-dihydroxy-3-(4-hydroxyphenyl)propanimidoyl]-1-thio-L-glucopyranose D-glucopyranose, 1-S-[(1Z,3R)-3-hydroxy-1-(hydroxyimino)-3-(4-hydroxyphenyl)propyl]-1-thio- InChI=1/C15H21NO8S/c17-6-10-12(20)13(21)14(22)15(24-10)25-11(16-23)5-9(19)7-1-3-8(18)4-2-7/h1-4,9-10,12-15,17-23H,5-6H2/b16-11-/t9-,10-,12-,13+,14-,15?/m1/s1 NGBUVHPKIVDZQW-WOJCROJEBZ Desulfo (R)-2-hydroxy-2-(4-hydroxyphenyl)ethylglucosinolate Desulfo p-hydroxyglucosibarin . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
11-Hydroxy-9-hydroxymethyl-10-[3-(4-hydroxy-phenyl)-acryloyloxy]-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydro-2H-picene-4a-carboxylic acid (2alpha,3beta,5xi,9xi,18xi)-2,23-dihydroxy-3-{[(2Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}olean-12-en-28-oic acid olean-12-en-28-oic acid, 2,23-dihydroxy-3-[[(2Z)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]oxy]-, (2alpha,3beta,5xi,9xi,18xi)- InChI=1/C39H54O7/c1-34(2)17-19-39(33(44)45)20-18-37(5)26(27(39)21-34)12-13-30-35(3)22-28(42)32(36(4,23-40)29(35)15-16-38(30,37)6)46-31(43)14-9-24-7-10-25(41)11-8-24/h7-12,14,27-30,32,40-42H,13,15-23H2,1-6H3,(H,44,45)/b14-9-/t27?,28-,29?,30?,32+,35+,36+,3 ZDHQMVKMQGQHJQ-NNYNJIQEBU 3β-cis-p-Coumaroyloxy-2α,23-dihydroxyolean-12-en-28-oic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
2-Acetoxy-3-[3-(4-hydroxy-phenyl)-acryloyloxy]-succinic acid 2-(acetyloxy)-3-{[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}succinic acid butanedioic acid, 2-(acetyloxy)-3-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]oxy]- InChI=1/C15H14O9/c1-8(16)23-12(14(19)20)13(15(21)22)24-11(18)7-4-9-2-5-10(17)6-3-9/h2-7,12-13,17H,1H3,(H,19,20)(H,21,22)/b7-4+ AILCSCQIQZTQJR-QPJJXVBHBI 2-Acetoxy-3-[3-(4-hydroxy-phenyl)-acryloyloxy]-succinic acid . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
5-[2-(3-Hydroxy-phenyl)-ethyl]-2-(3-methyl-but-2-enyl)-3-(3-methyl-but-2-enyloxy)-phenol 5-[2-(3-hydroxyphenyl)ethyl]-2-(3-methylbut-2-en-1-yl)-3-[(3-methylbut-2-en-1-yl)oxy]phenol phenol, 5-[2-(3-hydroxyphenyl)ethyl]-2-(3-methyl-2-butenyl)-3-[(3-methyl-2-butenyl)oxy]- InChI=1/C24H30O3/c1-17(2)8-11-22-23(26)15-20(16-24(22)27-13-12-18(3)4)10-9-19-6-5-7-21(25)14-19/h5-8,12,14-16,25-26H,9-11,13H2,1-4H3 PXJDPPLCQZVKRC-UHFFFAOYAN 2-(3-Methyl-2-butenyl)-3-O-(3-methyl-2-butenyl)-5-[2-(3-hydroxyphenyl)ethyl]-1,3-benzenediol Glepidotin D . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
1-(3,4-Dihydroxy-2,2-dimethyl-chroman-6-yl)-ethanone rel-1-[(3R,4S)-3,4-dihydroxy-2,2-dimethyl-3,4-dihydro-2H-chromen-6-yl]ethanone ethanone, 1-[(3S,4R)-3,4-dihydro-3,4-dihydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl]- InChI=1/C13H16O4/c1-7(14)8-4-5-10-9(6-8)11(15)12(16)13(2,3)17-10/h4-6,11-12,15-16H,1-3H3/t11-,12+/m1/s1 AMJRVNUEWFTIFW-NEPJUHHUBI (3S,4R)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1alpha,5beta,6beta,7alpha,8alpha,9beta,10alpha,13alpha,14R,20S)-6,7,14,20-tetrahydroxy-15-oxo-7,20-epoxykaur-16-en-1-yl rel-acetate bisoxireno[4,5:8,9]cyclodeca[1,2-b]furan-4(1aH)-one, 2,2a,6,6a,7a,8,9,9a-octahydro-6-hydroxy-1a,5,7a-trimethyl-, (1aS,2aS,6R,7aR)- InChI=1/C22H30O8/c1-9-11-5-6-12-20-13(29-10(2)23)7-8-19(3,4)14(20)17(26)22(28,30-18(20)27)21(12,15(9)24)16(11)25/h11-14,16-18,25-28H,1,5-8H2,2-4H3/t11-,12-,13-,14+,16+,17-,18-,20-,21-,22+/m0/s1 WASCTSNYBVCLTC-YCVPHQFIBA 1α-Acetoxy-6β,7β,14β,20(R)-tetrahydroxy-7α,20-epoxy-ent-kaur-16-en-15-one Xerophilusin J . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 7-(5-benzyl-8,8-dimethyl-4,7,10,13-tetraoxo-tetradecahydro-3a,6,9,12-tetraaza-cyclopentacyclododecen-11-yl)-1-methyl-2-oxo-heptyl ester (1R)-7-[(3S,9S,14aR)-9-benzyl-6,6-dimethyl-1,4,7,10-tetraoxotetradecahydropyrrolo[1,2-a][1,4,7,10]tetraazacyclododecin-3-yl]-1-methyl-2-oxoheptyl rel-acetate InChI=1/C30H42N4O7/c1-19(41-20(2)35)25(36)16-10-6-9-14-22-26(37)33-30(3,4)29(40)32-23(18-21-12-7-5-8-13-21)28(39)34-17-11-15-24(34)27(38)31-22/h5,7-8,12-13,19,22-24H,6,9-11,14-18H2,1-4H3,(H,31,38)(H,32,40)(H,33,37)/t19-,22+,23+,24-/m1/s1 DGYUADDUGZTHSO-QLBRKBSLBT Acetic acid 7-(5-benzyl-8,8-dimethyl-4,7,10,13-tetraoxo-tetradecahydro-3a,6,9,12-tetraaza-cyclopentacyclododecen-11-yl)-1-methyl-2-oxo-heptyl ester . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
rel-(1aR,2aR,6S,7aS)-6-hydroxy-1a,5,7a-trimethyl-2,2a,6,6a,7a,8,9,9a-octahydrobisoxireno[4,5:8,9]cyclodeca[1,2-b]furan-4(1aH)-one bisoxireno[4,5:8,9]cyclodeca[1,2-b]furan-4(1aH)-one, 2,2a,6,6a,7a,8,9,9a-octahydro-6-hydroxy-1a,5,7a-trimethyl-, (1aS,2aS,6R,7aR)- InChI=1/C15H20O5/c1-7-10-8(18-13(7)17)6-15(3)9(19-15)4-5-14(2)12(20-14)11(10)16/h8-9,11-12,16H,4-6H2,1-3H3/t8-,9?,11+,12?,14+,15-/m0/s1 BWSYOMVQMMVGIN-RSFNDTQVBE 1β,10α,4α,5β-Diepoxy-6β-hydroxyglechoman-8α,12-olide . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
(1beta,11beta,12alpha,15alpha)-1,11,12,14,15-pentahydroxy-11,20-epoxypicras-3-ene-2,16-dione picras-3-ene-2,16-dione, 11,20-epoxy-1,11,12,14,15-pentahydroxy-, (1beta,11beta,12alpha,15alpha)- InChI=1/C20H26O9/c1-7-4-10(21)13(23)17(3)9(7)5-11-18-6-28-20(27,16(17)18)12(22)8(2)19(18,26)14(24)15(25)29-11/h4,8-9,11-14,16,22-24,26-27H,5-6H2,1-3H3/t8-,9-,11+,12+,13+,14+,16+,17+,18+,19-,20-/m0/s1 PKICXNXDFYYYGH-IHCIPJKKBS Iandonone . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
Acetic acid 4-formyl-4-(2-furan-3-yl-2-oxo-ethyl)-5,7a,7b-trimethyl-decahydro-1-oxa-cyclopropa[a]naphthalen-6-yl ester (1aR,3aS,4S,5S,6R,7aR,7bS)-4-formyl-4-[2-(3-furyl)-2-oxoethyl]-5,7a,7b-trimethyldecahydronaphtho[1,2-b]oxiren-6-yl rel-acetate naphth[1,2-b]oxirene-4-carboxaldehyde, 6-(acetyloxy)-4-[2-(3-furanyl)-2-oxoethyl]decahydro-5,7a,7b-trimethyl-, (1aR,3aS,4S,5S,6R,7aR,7bS)- InChI=1/C22H28O6/c1-13-17(27-14(2)24)10-20(3)18(5-6-19-21(20,4)28-19)22(13,12-23)9-16(25)15-7-8-26-11-15/h7-8,11-13,17-19H,5-6,9-10H2,1-4H3/t13-,17-,18+,19-,20-,21-,22-/m1/s1 KGCOURSVJRGFJH-BZFQXQNWBW 7α-Acetoxy-3,4,15,16-diepoxy-12-oxo-cleroda-13(16),14-dien-20-al Cascarillin B . Information we have got: NMR spectra 13C, 3D coordinates, File formats: CML, mol, png, jpeg
The list is continued here