(5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-azanylethyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one

Systemtic Name: (5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-azanylethyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one Openeye Name: (5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-aminoethyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one CAS Name: (5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-aminoethyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one IUPAC Name: (5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-aminoethyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one Traditional Name: (5S,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-aminoethyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one Formula: C21H35NO MolecularWeight: 317.5087

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C)N

Isomeric SMILES

C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)C4)C)C)N

InChI

InChI=1S/C21H35NO/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-14,16-19H,4-12,22H2,1-3H3/t13-,14-,16-,17+,18-,19-,20-,21+/m0/s1