EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C32H44O9 |
| Net Charge | 0 |
| Average Mass | 572.695 |
| Monoisotopic Mass | 572.29853 |
| SMILES | CC(=O)O[C@H]1C(=O)C2=C([C@@H](O)C[C@H]3[C@](C)(CO)C(=O)CC[C@]23C)[C@]2(C)C(=O)C[C@H]([C@H](C)CC/C=C(\C)C(=O)O)[C@@]12C |
| InChI | InChI=1S/C32H44O9/c1-16(9-8-10-17(2)28(39)40)19-13-23(37)32(7)24-20(35)14-21-29(4,12-11-22(36)30(21,5)15-33)25(24)26(38)27(31(19,32)6)41-18(3)34/h10,16,19-21,27,33,35H,8-9,11-15H2,1-7H3,(H,39,40)/b17-10+/t16-,19-,20+,21-,27+,29+,30+,31+,32+/m1/s1 |
| InChIKey | HOPDNBIFYDWRMF-YULVEHMRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma leucocontextum (ncbitaxon:1566825) | - | PubMed (26287401) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Ganoleuconin D (CHEBI:206775) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| (E,6R)-6-[(4R,5R,7S,10S,12R,13R,14R,17R)-12-acetyloxy-7-hydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid |
| Manual Xrefs | Databases |
|---|---|
| 59003730 | ChemSpider |