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CHEBI:182502 - Avenastenone
| Formula | C29H46O |
| Net Charge | 0 |
| Average Mass | 410.686 |
| Monoisotopic Mass | 410.35487 |
| SMILES | [H][C@@]12CC=C3[C@]([H])(CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)CC/C(=C/C)C(C)C)[C@@]1(C)CCC(=O)C2 |
| InChI | InChI=1S/C29H46O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,11,19-20,22,25-27H,8-10,12-18H2,1-6H3/b21-7-/t20-,22+,25-,26+,27+,28+,29-/m1/s1 |
| InChIKey | XHRPJMCAEXVFFM-KADTVRCUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Avenastenone (CHEBI:182502) has parent hydride stigmastane (CHEBI:26773) |
| Avenastenone (CHEBI:182502) is a steroid (CHEBI:35341) |
| IUPAC Name |
|---|
| (5S,9R,10S,13R,14R,17R)-10,13-dimethyl-17-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one |