(5S,8R,9S,10R,13S,14S,17S)-4-bromanyl-5,13-dimethyl-17-oxidanyl-4,6,7,8,9,10,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

Systemtic Name: (5S,8R,9S,10R,13S,14S,17S)-4-bromanyl-5,13-dimethyl-17-oxidanyl-4,6,7,8,9,10,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Openeye Name: (5S,8R,9S,10R,13S,14S,17S)-4-bromo-17-hydroxy-5,13-dimethyl-4,6,7,8,9,10,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one CAS Name: (5S,8R,9S,10R,13S,14S,17S)-4-bromo-17-hydroxy-5,13-dimethyl-4,6,7,8,9,10,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one IUPAC Name: (5S,8R,9S,10R,13S,14S,17S)-4-bromo-17-hydroxy-5,13-dimethyl-4,6,7,8,9,10,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Traditional Name: (5S,8R,9S,10R,13S,14S,17S)-4-bromo-17-hydroxy-5,13-dimethyl-4,6,7,8,9,10,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one Formula: C19H27BrO2 MolecularWeight: 367.32048

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2O)CCC4(C3C=CC(=O)C4Br)C

Isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CC[C@]4([C@@H]3C=CC(=O)C4Br)C

InChI

InChI=1S/C19H27BrO2/c1-18-9-7-12-11(13(18)4-6-16(18)22)8-10-19(2)14(12)3-5-15(21)17(19)20/h3,5,11-14,16-17,22H,4,6-10H2,1-2H3/t11-,12+,13+,14-,16+,17?,18+,19+/m1/s1