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CHEBI:203642 - Spongiporic acid A
| Formula | C31H44O6 |
| Net Charge | 0 |
| Average Mass | 512.687 |
| Monoisotopic Mass | 512.31379 |
| SMILES | C=C(C(=O)CC(C)(O)[C@H]1CC[C@@]2(C)C3=CC[C@H](C(=C)C)[C@](C)(CCC(=O)O)C3=CC[C@]12C)C(C)C(=O)O |
| InChI | InChI=1S/C31H44O6/c1-18(2)21-9-10-23-22(28(21,5)14-13-26(33)34)11-15-30(7)25(12-16-29(23,30)6)31(8,37)17-24(32)19(3)20(4)27(35)36/h10-11,20-21,25,37H,1,3,9,12-17H2,2,4-8H3,(H,33,34)(H,35,36)/t20?,21-,25+,28+,29+,30-,31?/m1/s1 |
| InChIKey | GJTWWQXLOACZKG-STIXBJEESA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma lucidum (ncbitaxon:5315) | - | PubMed (16356517) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Spongiporic acid A (CHEBI:203642) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| 6-[(3S,3aR,6S,7R,9bR)-6-(2-carboxyethyl)-3a,6,9b-trimethyl-7-prop-1-en-2-yl-1,2,3,4,7,8-hexahydrocyclopenta[a]naphthalen-3-yl]-6-hydroxy-2-methyl-3-methylidene-4-oxoheptanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 78442575 | ChemSpider |