(9R,10S,13R,17R)-17-[(2R)-5-(dimethylamino)pentan-2-yl]-10,13-dimethyl-3-oxidanyl-1,2,3,4,5,6,7,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-15-one

Systemtic Name: (9R,10S,13R,17R)-17-[(2R)-5-(dimethylamino)pentan-2-yl]-10,13-dimethyl-3-oxidanyl-1,2,3,4,5,6,7,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-15-one Openeye Name: (9R,10S,13R,17R)-17-[(1R)-4-(dimethylamino)-1-methyl-butyl]-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-15-one CAS Name: (9R,10S,13R,17R)-17-[(2R)-5-(dimethylamino)pentan-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-15-one IUPAC Name: (9R,10S,13R,17R)-17-[(2R)-5-(dimethylamino)pentan-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-15-one Traditional Name: (9R,10S,13R,17R)-17-[(1R)-4-(dimethylamino)-1-methyl-butyl]-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,16,17-dodecahydrocyclopenta[a]phenanthren-15-one Formula: C26H43NO2 MolecularWeight: 401.62512

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCN(C)C)C1CC(=O)C2=C3CCC4CC(CCC4(C3CCC12C)C)O

Isomeric SMILES

C[C@H](CCCN(C)C)[C@H]1CC(=O)C2=C3CCC4CC(CC[C@@]4([C@H]3CC[C@]12C)C)O

InChI

InChI=1S/C26H43NO2/c1-17(7-6-14-27(4)5)22-16-23(29)24-20-9-8-18-15-19(28)10-12-25(18,2)21(20)11-13-26(22,24)3/h17-19,21-22,28H,6-16H2,1-5H3/t17-,18?,19?,21+,22-,25+,26-/m1/s1