[(5R,6R,8S,9S,10R,13S,14S)-5-fluoranyl-6-methoxy-10,13-dimethyl-17-oxidanylidene-2,3,4,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate

Systemtic Name: [(5R,6R,8S,9S,10R,13S,14S)-5-fluoranyl-6-methoxy-10,13-dimethyl-17-oxidanylidene-2,3,4,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate Openeye Name: [(5R,6R,8S,9S,10R,13S,14S)-5-fluoro-6-methoxy-10,13-dimethyl-17-oxo-2,3,4,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate CAS Name: acetic acid [(5R,6R,8S,9S,10R,13S,14S)-5-fluoro-6-methoxy-10,13-dimethyl-17-oxo-2,3,4,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [(5R,6R,8S,9S,10R,13S,14S)-5-fluoro-6-methoxy-10,13-dimethyl-17-oxo-2,3,4,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate Traditional Name: acetic acid [(5R,6R,8S,9S,10R,13S,14S)-5-fluoro-17-keto-6-methoxy-10,13-dimethyl-2,3,4,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester Formula: C22H33FO4 MolecularWeight: 380.493423

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC2(C3CCC4(C(C3CC(C2(C1)F)OC)CCC4=O)C)C

Isomeric SMILES

CC(=O)OC1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3C[C@H]([C@]2(C1)F)OC)CCC4=O)C)C

InChI

InChI=1S/C22H33FO4/c1-13(24)27-14-7-10-21(3)17-8-9-20(2)16(5-6-18(20)25)15(17)11-19(26-4)22(21,23)12-14/h14-17,19H,5-12H2,1-4H3/t14?,15-,16-,17-,19+,20-,21+,22-/m0/s1