1-[(2S,3S,5S,10S,13S,17S)-10,13-dimethyl-2-[(2S)-2-methylmorpholin-4-yl]-3-oxidanyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone

Systemtic Name: 1-[(2S,3S,5S,10S,13S,17S)-10,13-dimethyl-2-[(2S)-2-methylmorpholin-4-yl]-3-oxidanyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone Openeye Name: 1-[(2S,3S,5S,10S,13S,17S)-3-hydroxy-10,13-dimethyl-2-[(2S)-2-methylmorpholin-4-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone CAS Name: 1-[(2S,3S,5S,10S,13S,17S)-3-hydroxy-10,13-dimethyl-2-[(2S)-2-methyl-4-morpholinyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone IUPAC Name: 1-[(2S,3S,5S,10S,13S,17S)-3-hydroxy-10,13-dimethyl-2-[(2S)-2-methylmorpholin-4-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone Traditional Name: 1-[(2S,3S,5S,10S,13S,17S)-3-hydroxy-10,13-dimethyl-2-[(2S)-2-methylmorpholino]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone Formula: C26H43NO3 MolecularWeight: 417.62452

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)C2CC3(C(CCC4C3CCC5(C4CCC5C(=O)C)C)CC2O)C

Isomeric SMILES

C[C@H]1CN(CCO1)[C@H]2C[C@]3([C@@H](CCC4C3CC[C@]5(C4CC[C@@H]5C(=O)C)C)C[C@@H]2O)C

InChI

InChI=1S/C26H43NO3/c1-16-15-27(11-12-30-16)23-14-26(4)18(13-24(23)29)5-6-19-21-8-7-20(17(2)28)25(21,3)10-9-22(19)26/h16,18-24,29H,5-15H2,1-4H3/t16-,18-,19?,20+,21?,22?,23-,24-,25+,26-/m0/s1