17-acetyloxy-9-fluoranyl-16-(fluoranylmethyl)-10,13-dimethyl-11-oxidanyl-3-oxidanylidene-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carbothioic S-acid

Systemtic Name: 17-acetyloxy-9-fluoranyl-16-(fluoranylmethyl)-10,13-dimethyl-11-oxidanyl-3-oxidanylidene-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carbothioic S-acid Openeye Name: 17-acetoxy-9-fluoro-16-(fluoromethyl)-11-hydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carbothioic S-acid CAS Name: 17-acetyloxy-9-fluoro-16-(fluoromethyl)-11-hydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carbothioic S-acid IUPAC Name: 17-acetyloxy-9-fluoro-16-(fluoromethyl)-11-hydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carbothioic S-acid Traditional Name: 17-acetoxy-9-fluoro-16-(fluoromethyl)-11-hydroxy-3-keto-10,13-dimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carbothioic S-acid Formula: C23H28F2O5S MolecularWeight: 454.527226

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)CF)C(=O)S

Isomeric SMILES

CC(=O)OC1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)CF)C(=O)S

InChI

InChI=1S/C23H28F2O5S/c1-12(26)30-23(19(29)31)14(11-24)9-17-16-5-4-13-8-15(27)6-7-20(13,2)22(16,25)18(28)10-21(17,23)3/h6-8,14,16-18,28H,4-5,9-11H2,1-3H3,(H,29,31)