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

Systemtic Name: [2-[(6S,17S)-16-acetyloxy-6-fluoranyl-10,13-dimethyl-11,17-bis(oxidanyl)-3-oxidanylidene-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethyl] ethanoate Openeye Name: [2-[(6S,17S)-16-acetoxy-6-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] acetate CAS Name: acetic acid [2-[(6S,17S)-16-acetyloxy-6-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] ester IUPAC Name: [2-[(6S,17S)-16-acetyloxy-6-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate Traditional Name: acetic acid [2-[(6S,17S)-16-acetoxy-6-fluoro-11,17-dihydroxy-3-keto-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-keto-ethyl] ester Formula: C25H35FO8 MolecularWeight: 482.539003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)C1(C(CC2C1(CC(C3C2CC(C4C3(CCC(=O)C4)C)F)O)C)OC(=O)C)O

Isomeric SMILES

CC(=O)OCC(=O)[C@]1(C(CC2C1(CC(C3C2C[C@@H](C4C3(CCC(=O)C4)C)F)O)C)OC(=O)C)O

InChI

InChI=1S/C25H35FO8/c1-12(27)33-11-20(31)25(32)21(34-13(2)28)9-16-15-8-18(26)17-7-14(29)5-6-23(17,3)22(15)19(30)10-24(16,25)4/h15-19,21-22,30,32H,5-11H2,1-4H3/t15?,16?,17?,18-,19?,21?,22?,23?,24?,25+/m0/s1