(NE)-N-[(2R,5S,8R,9S,10S,13R,14S,17R)-2-azanyl-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ylidene]hydroxylamine

Systemtic Name: (NE)-N-[(2R,5S,8R,9S,10S,13R,14S,17R)-2-azanyl-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ylidene]hydroxylamine Openeye Name: (2R,5S,8R,9S,10S,13R,14S,17R)-2-amino-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one oxime CAS Name: (2R,5S,8R,9S,10S,13R,14S,17R)-2-amino-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one oxime IUPAC Name: (NE)-N-[(2R,5S,8R,9S,10S,13R,14S,17R)-2-amino-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ylidene]hydroxylamine Traditional Name: (2R,5S,8R,9S,10S,13R,14S,17R)-2-amino-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one oxime Formula: C27H48N2O MolecularWeight: 416.68282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CC(C(=NO)C4)N)C)C

Isomeric SMILES

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

InChI

InChI=1S/C27H48N2O/c1-17(2)7-6-8-18(3)21-11-12-22-20-10-9-19-15-25(29-30)24(28)16-27(19,5)23(20)13-14-26(21,22)4/h17-24,30H,6-16,28H2,1-5H3/b29-25+/t18-,19+,20+,21-,22+,23+,24-,26-,27+/m1/s1