[(3S,8R,9S,10R,13S,14S)-6-fluoranyl-10,13-dimethyl-17-oxidanylidene-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] 2,2-dimethylpropanoate

Systemtic Name: [(3S,8R,9S,10R,13S,14S)-6-fluoranyl-10,13-dimethyl-17-oxidanylidene-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] 2,2-dimethylpropanoate Openeye Name: [(3S,8R,9S,10R,13S,14S)-6-fluoro-10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(3S,8R,9S,10R,13S,14S)-6-fluoro-10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [(3S,8R,9S,10R,13S,14S)-6-fluoro-10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(3S,8R,9S,10R,13S,14S)-6-fluoro-17-keto-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] ester Formula: C24H35FO3 MolecularWeight: 390.531303

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2=O)CC(=C4C3(CCC(C4)OC(=O)C(C)(C)C)C)F

Isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC(=C4[C@@]3(CC[C@@H](C4)OC(=O)C(C)(C)C)C)F

InChI

InChI=1S/C24H35FO3/c1-22(2,3)21(27)28-14-8-10-23(4)17-9-11-24(5)16(6-7-20(24)26)15(17)13-19(25)18(23)12-14/h14-17H,6-13H2,1-5H3/t14-,15-,16-,17-,23+,24-/m0/s1