[(8S,9S,10R,13S,14S,17S)-17-ethanoyl-10,13-dimethyl-3,11-bis(oxidanylidene)-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-12-yl] ethanoate

Systemtic Name: [(8S,9S,10R,13S,14S,17S)-17-ethanoyl-10,13-dimethyl-3,11-bis(oxidanylidene)-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-12-yl] ethanoate Openeye Name: [(8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3,11-dioxo-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-12-yl] acetate CAS Name: acetic acid [(8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3,11-dioxo-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-12-yl] ester IUPAC Name: [(8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3,11-dioxo-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-12-yl] acetate Traditional Name: acetic acid [(8S,9S,10R,13S,14S,17S)-17-acetyl-3,11-diketo-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-12-yl] ester Formula: C23H30O5 MolecularWeight: 386.4813

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CCC2C1(C(C(=O)C3C2CCC4=CC(=O)CCC34C)OC(=O)C)C

Isomeric SMILES

CC(=O)[C@H]1CC[C@@H]2[C@@]1(C(C(=O)[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)OC(=O)C)C

InChI

InChI=1S/C23H30O5/c1-12(24)17-7-8-18-16-6-5-14-11-15(26)9-10-22(14,3)19(16)20(27)21(23(17,18)4)28-13(2)25/h11,16-19,21H,5-10H2,1-4H3/t16-,17+,18-,19+,21?,22-,23+/m0/s1