[(8R,9S,13S,14S)-3-acetyloxy-2-fluoranyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] ethanoate

Systemtic Name: [(8R,9S,13S,14S)-3-acetyloxy-2-fluoranyl-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] ethanoate Openeye Name: [(8R,9S,13S,14S)-3-acetoxy-2-fluoro-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] acetate CAS Name: acetic acid [(8R,9S,13S,14S)-3-acetyloxy-2-fluoro-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] ester IUPAC Name: [(8R,9S,13S,14S)-3-acetyloxy-2-fluoro-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] acetate Traditional Name: acetic acid [(8R,9S,13S,14S)-3-acetoxy-2-fluoro-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] ester Formula: C22H25FO4 MolecularWeight: 372.429903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CCC2C1(CCC3C2CCC4=CC(=C(C=C34)F)OC(=O)C)C

Isomeric SMILES

CC(=O)OC1=CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=C(C=C34)F)OC(=O)C)C

InChI

InChI=1S/C22H25FO4/c1-12(24)26-20-10-14-4-5-16-15(17(14)11-19(20)23)8-9-22(3)18(16)6-7-21(22)27-13(2)25/h7,10-11,15-16,18H,4-6,8-9H2,1-3H3/t15-,16+,18-,22-/m0/s1