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CHEBI:201003 - 3beta-acetoxyfern-9(11)-en-19-one
| Formula | C32H50O3 |
| Net Charge | 0 |
| Average Mass | 482.749 |
| Monoisotopic Mass | 482.37600 |
| SMILES | CC(=O)O[C@H]1CC[C@]2(C)C3=CC[C@@]4(C)[C@@H]5C(=O)C[C@H](C(C)C)[C@@]5(C)CC[C@]4(C)[C@H]3CC[C@H]2C1(C)C |
| InChI | InChI=1S/C32H50O3/c1-19(2)23-18-24(34)27-30(23,7)16-17-31(8)22-10-11-25-28(4,5)26(35-20(3)33)13-14-29(25,6)21(22)12-15-32(27,31)9/h12,19,22-23,25-27H,10-11,13-18H2,1-9H3/t22-,23+,25-,26-,27+,29+,30+,31+,32-/m0/s1 |
| InChIKey | JSANFJCENIDTSC-XSPVRDDTSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Pyxine berteroana (ncbitaxon:2884777) | - | PubMed (19848435) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3beta-acetoxyfern-9(11)-en-19-one (CHEBI:201003) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| [(3R,3aR,5aR,5bR,7aR,9S,11aS,13aS,13bR)-3a,5a,8,8,11a,13a-hexamethyl-1-oxo-3-propan-2-yl-3,4,5,5b,6,7,7a,9,10,11,13,13b-dodecahydro-2H-cyclopenta[a]chrysen-9-yl] acetate |
| Manual Xrefs | Databases |
|---|---|
| 78442524 | ChemSpider |