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CHEBI:220942 - Fomitoside A
| Formula | C35H54O8 |
| Net Charge | 0 |
| Average Mass | 602.809 |
| Monoisotopic Mass | 602.38187 |
| SMILES | CC(C)(O)/C=C/C[C@@H](C(=O)O[C@@H]1[C@@H](O)[C@H](O)CO[C@H]1O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3 |
| InChI | InChI=1S/C35H54O8/c1-31(2,41)15-8-9-20(29(39)43-28-27(38)24(36)19-42-30(28)40)21-12-17-35(7)23-10-11-25-32(3,4)26(37)14-16-33(25,5)22(23)13-18-34(21,35)6/h8,15,20-21,24-25,27-28,30,36,38,40-41H,9-14,16-19H2,1-7H3/b15-8+/t20-,21-,24-,25+,27+,28-,30-,33-,34-,35+/m1/s1 |
| InChIKey | PIXBMLWQDSJWSM-JCGSAEKZSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Fomitopsis pinicola (ncbitaxon:40483) | - | PubMed (15679320) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Fomitoside A (CHEBI:220942) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| [(2R,3R,4S,5R)-2,4,5-trihydroxyoxan-3-yl] (E,2R)-6-hydroxy-6-methyl-2-[(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]hept-4-enoate |
| Manual Xrefs | Databases |
|---|---|
| 78437670 | ChemSpider |