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CHEBI:154830 - CID 91859658

ChEBI IDCHEBI:154830
ChEBI NameCID 91859658
Stars
SubmitterGareth Owen
DownloadsMolfile
FormulaC108H180N6O78
Net Charge0
Average Mass2810.592
Monoisotopic Mass2809.03029
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)C(O)O[C@@H]2CO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H](O[C@@H]5O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]5O)[C@H]4NC(C)=O)[C@@H](O)[C@H](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@H](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H](O[C@@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]4O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
WURCSWURCS=2.0/6,16,15/[a2122h-1x_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a1221m-1a_1-5][a2112h-1b_1-5]/1-2-3-4-2-5-6-2-6-4-2-6-2-5-6-5/a4-b1_a6-p1_b4-c1_c3-d1_c6-j1_d2-e1_d4-h1_e3-f1_e4-g1_h4-i1_j2-k1_j6-m1_k4-l1_m3-n1_m4-o1
InChIInChI=1S/C108H180N6O78/c1-23-51(131)64(144)72(152)99(165-23)163-22-44-85(60(140)45(93(161)168-44)109-26(4)125)182-96-47(111-28(6)127)62(142)83(38(16-121)175-96)185-106-80(160)90(190-108-92(79(159)84(39(17-122)178-108)181-95-46(110-27(5)126)61(141)81(36(14-119)174-95)183-102-75(155)67(147)54(134)32(10-115)169-102)192-98-50(114-31(9)130)89(189-101-74(154)66(146)53(133)25(3)167-101)87(41(19-124)177-98)187-105-78(158)70(150)57(137)35(13-118)172-105)59(139)43(179-106)21-164-107-91(191-97-48(112-29(7)128)63(143)82(37(15-120)176-97)184-103-76(156)68(148)55(135)33(11-116)170-103)71(151)58(138)42(180-107)20-162-94-49(113-30(8)129)88(188-100-73(153)65(145)52(132)24(2)166-100)86(40(18-123)173-94)186-104-77(157)69(149)56(136)34(12-117)171-104/h23-25,32-108,115-124,131-161H,10-22H2,1-9H3,(H,109,125)(H,110,126)(H,111,127)(H,112,128)(H,113,129)(H,114,130)/t23-,24-,25-,32+,33+,34+,35+,36+,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53+,54-,55-,56-,57-,58+,59+,60+,61+,62+,63+,64+,65+,66+,67-,68-,69-,70-,71-,72-,73-,74-,75+,76+,77+,78+,79-,80-,81+,82+,83+,84+,85+,86+,87+,88+,89+,90-,91-,92-,93?,94+,95-,96-,97-,98-,99+,100-,101-,102-,103-,104-,105-,106-,107-,108+/m0/s1
InChIKeyYMLZXUQKMCIKJW-LVIFDLICSA-N
ChEBI Ontology
Outgoing Relation(s)
CID 91859658 (CHEBI:154830) is a polysaccharide (CHEBI:18154)
Synonyms  Source
6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->3)-[beta-D-galacto-hexopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->6)]-2-acetamido-2-deoxy-D-gluco-hexopyranoseSUBMITTER
Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-2)[Gal(b1-4)GlcNAc(b1-4)]Man(a1-3)[Gal(b1-4)GlcNAc(b1-2)[Fuc(a1-3)[Gal(b1-4)]GlcNAc(b1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]GlcNAcSUBMITTER
Manual XrefsDatabases
G87260SOGlyTouCan
G87260SOGlyGen