EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C78H124N4O22 |
| Net Charge | 0 |
| Average Mass | 1469.856 |
| Monoisotopic Mass | 1468.87072 |
| SMILES | CO[C@H]1CC=CC=C[C@H](OC)C[C@H](O)CC(=O)O[C@@H](C[C@H](OC)[C@@H](C)CCC(=O)[C@H](C)[C@@H](C/C=C/N(C)C=O)OC)C(C)(C)C(O)Cc2nc(co2)[C@@H](OC)CC=CC=C[C@H](OC)C[C@H](O)CC(=O)O[C@@H](C[C@H](OC)[C@@H](C)CCC(=O)[C@H](C)[C@@H](C/C=C/N(C)C=O)OC)C(C)(C)C(O)Cc2nc1co2 |
| InChI | InChI=1S/C78H124N4O22/c1-51(33-35-61(87)53(3)63(95-13)31-25-37-81(9)49-83)67(99-17)43-71-77(5,6)69(89)45-73-79-59(47-101-73)65(97-15)29-23-20-22-28-58(94-12)40-56(86)42-76(92)104-72(44-68(100-18)52(2)34-36-62(88)54(4)64(96-14)32-26-38-82(10)50-84)78(7,8)70(90)46-74-80-60(48-102-74)66(98-16)30-24-19-21-27-57(93-11)39-55(85)41-75(91)103-71/h19-28,37-38,47-58,63-72,85-86,89-90H,29-36,39-46H2,1-18H3/b23-20?,24-19?,27-21?,28-22?,37-25+,38-26+/t51-,52-,53-,54-,55-,56-,57-,58-,63+,64+,65-,66-,67-,68-,69?,70?,71-,72-/m0/s1 |
| InChIKey | MWDPPGCTEBRUNT-QUJGBNPVSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Myxococcus stipitatus (ncbitaxon:83455) | - | PubMed (8514628) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Rhizopodin (CHEBI:218973) is a macrolide (CHEBI:25106) |
| IUPAC Name |
|---|
| N-[(E,4R,5R,9S,10S)-11-[(5S,9S,11R,17S,25S,29S,31R,37S)-25-[(E,2S,3S,7R,8R)-11-[ormyl(methyl)amino]-2,8-dimethoxy-3,7-dimethyl-6-oxoundec-10-enyl]-3,9,23,29-tetrahydroxy-11,17,31,37-tetramethoxy-4,4,24,24-tetramethyl-7,27-dioxo-6,20,26,40-tetraoxa-41,42-diazatricyclo[36.2.1.118,21]dotetraconta-1(41),12,14,18,21(42),32,34,38-octaen-5-yl]-4,10-dimethoxy-5,9-dimethyl-6-oxoundec-1-enyl]-N-methylormamide |