(6E,8R,9S,13S,14S,17S)-2-methoxy-13-methyl-6-[[4-(trifluoromethyloxy)phenyl]methoxyimino]-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthrene-3,17-diol

Systemtic Name: (6E,8R,9S,13S,14S,17S)-2-methoxy-13-methyl-6-[[4-(trifluoromethyloxy)phenyl]methoxyimino]-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthrene-3,17-diol Openeye Name: (6E,8R,9S,13S,14S,17S)-2-methoxy-13-methyl-6-[[4-(trifluoromethoxy)phenyl]methoxyimino]-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthrene-3,17-diol CAS Name: (6E,8R,9S,13S,14S,17S)-2-methoxy-13-methyl-6-[[4-(trifluoromethoxy)phenyl]methoxyimino]-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthrene-3,17-diol IUPAC Name: (6E,8R,9S,13S,14S,17S)-2-methoxy-13-methyl-6-[[4-(trifluoromethoxy)phenyl]methoxyimino]-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthrene-3,17-diol Traditional Name: (6E,8R,9S,13S,14S,17S)-2-methoxy-13-methyl-6-[4-(trifluoromethoxy)benzyl]oximino-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthrene-3,17-diol Formula: C27H30F3NO5 MolecularWeight: 505.52601

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2O)CC(=NOCC4=CC=C(C=C4)OC(F)(F)F)C5=CC(=C(C=C35)OC)O

Isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)C/C(=N\OCC4=CC=C(C=C4)OC(F)(F)F)/C5=CC(=C(C=C35)OC)O

InChI

InChI=1S/C27H30F3NO5/c1-26-10-9-17-18-13-24(34-2)23(32)12-20(18)22(11-19(17)21(26)7-8-25(26)33)31-35-14-15-3-5-16(6-4-15)36-27(28,29)30/h3-6,12-13,17,19,21,25,32-33H,7-11,14H2,1-2H3/b31-22+/t17-,19-,21+,25+,26+/m1/s1