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CHEBI:219861 - 3beta,7beta,15beta-trihydroxy-11,23-dioxo-lanost-8,16-dien-26-oic acid methyl ester
| Formula | C31H46O7 |
| Net Charge | 0 |
| Average Mass | 530.702 |
| Monoisotopic Mass | 530.32435 |
| SMILES | COC(=O)C(C)CC(=O)C[C@@H](C)C1=C[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/C31H46O7/c1-16(11-18(32)12-17(2)27(37)38-8)19-13-24(36)31(7)26-20(33)14-22-28(3,4)23(35)9-10-29(22,5)25(26)21(34)15-30(19,31)6/h13,16-17,20,22-24,33,35-36H,9-12,14-15H2,1-8H3/t16-,17?,20+,22+,23+,24-,29+,30-,31+/m1/s1 |
| InChIKey | CWKRZZXKJFNDBT-AXBDTHOQSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma tropicum (ncbitaxon:36077) | - | PubMed (23421432) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3beta,7beta,15beta-trihydroxy-11,23-dioxo-lanost-8,16-dien-26-oic acid methyl ester (CHEBI:219861) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| methyl (6R)-2-methyl-4-oxo-6-[(3S,5R,7S,10S,13R,14R,15R)-3,7,15-trihydroxy-4,4,10,13,14-pentamethyl-11-oxo-1,2,3,5,6,7,12,15-octahydrocyclopenta[a]phenanthren-17-yl]heptanoate |
| Manual Xrefs | Databases |
|---|---|
| 78441177 | ChemSpider |