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CHEBI:218469 - Ganoderic acid XL5
| Formula | C31H48O8 |
| Net Charge | 0 |
| Average Mass | 548.717 |
| Monoisotopic Mass | 548.33492 |
| SMILES | COC(=O)C(C)[C@H](O)C(=O)C[C@@H](C)[C@H]1C[C@H](O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1C[C@@H]3O |
| InChI | InChI=1S/C31H48O8/c1-15(11-19(33)26(37)16(2)27(38)39-8)17-12-23(36)31(7)25-18(32)13-21-28(3,4)22(35)9-10-29(21,5)24(25)20(34)14-30(17,31)6/h15-18,21-23,26,32,35-37H,9-14H2,1-8H3/t15-,16?,17-,18+,21+,22+,23+,26+,29+,30-,31+/m1/s1 |
| InChIKey | CUFBLDXHAWKOJF-SGWXKGRTSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma (ncbitaxon:5314) | - | PubMed (28152606) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Ganoderic acid XL5 (CHEBI:218469) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| methyl (3S,6R)-3-hydroxy-2-methyl-4-oxo-6-[(3S,5R,7S,10S,13R,14R,15S,17R)-3,7,15-trihydroxy-4,4,10,13,14-pentamethyl-11-oxo-1,2,3,5,6,7,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]heptanoate |
| Manual Xrefs | Databases |
|---|---|
| 78441825 | ChemSpider |