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CHEBI:218464 - Ganoderic acid XL4
| Formula | C30H40O7 |
| Net Charge | 0 |
| Average Mass | 512.643 |
| Monoisotopic Mass | 512.27740 |
| SMILES | CC(CC(=O)C[C@@H](C)C1=CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3=O)C(=O)O |
| InChI | InChI=1S/C30H40O7/c1-15(10-17(31)11-16(2)26(36)37)18-12-23(35)30(7)25-19(32)13-21-27(3,4)22(34)8-9-28(21,5)24(25)20(33)14-29(18,30)6/h12,15-16,21-22,34H,8-11,13-14H2,1-7H3,(H,36,37)/t15-,16?,21+,22+,28+,29-,30+/m1/s1 |
| InChIKey | ZEZOCVNPUPKLKN-KPXGYEOXSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma (ncbitaxon:5314) | - | PubMed (28152606) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Ganoderic acid XL4 (CHEBI:218464) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| (6R)-6-[(3S,5R,10S,13R,14R)-3-hydroxy-4,4,10,13,14-pentamethyl-7,11,15-trioxo-1,2,3,5,6,12-hexahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 78441824 | ChemSpider |