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CHEBI:209804 - Saponaceoic acid III
| Formula | C30H48O4 |
| Net Charge | 0 |
| Average Mass | 472.710 |
| Monoisotopic Mass | 472.35526 |
| SMILES | C=C(C)[C@H](O)CC[C@@H](C(=O)O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3 |
| InChI | InChI=1S/C30H48O4/c1-18(2)23(31)10-8-19(26(33)34)20-12-16-30(7)22-9-11-24-27(3,4)25(32)14-15-28(24,5)21(22)13-17-29(20,30)6/h19-20,23-25,31-32H,1,8-17H2,2-7H3,(H,33,34)/t19-,20-,23-,24+,25+,28-,29-,30+/m1/s1 |
| InChIKey | SKTOHBBYPZVTFX-GEFITEMGSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Tricholoma saponaceum (ncbitaxon:113602) | - | PubMed (12499599) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Saponaceoic acid III (CHEBI:209804) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| (2R,5R)-5-hydroxy-2-[(3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-6-enoic acid |
| Manual Xrefs | Databases |
|---|---|
| 78438482 | ChemSpider |