(10,13-dimethyl-17-octan-2-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl) 4-[3,4-dimethyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]cyclohexane-1-carboxylate

Systemtic Name: (10,13-dimethyl-17-octan-2-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl) 4-[3,4-dimethyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]cyclohexane-1-carboxylate Openeye Name: [10,13-dimethyl-17-(1-methylheptyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] 4-(3,4-dimethyl-2,5-dioxo-pyrrolidin-1-yl)cyclohexanecarboxylate CAS Name: 4-(3,4-dimethyl-2,5-dioxo-1-pyrrolidinyl)-1-cyclohexanecarboxylic acid (10,13-dimethyl-17-octan-2-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl) ester IUPAC Name: (10,13-dimethyl-17-octan-2-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl) 4-(3,4-dimethyl-2,5-dioxopyrrolidin-1-yl)cyclohexane-1-carboxylate Traditional Name: 4-(2,5-diketo-3,4-dimethyl-pyrrolidino)cyclohexanecarboxylic acid [10,13-dimethyl-17-(1-methylheptyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester Formula: C40H65NO4 MolecularWeight: 623.9484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OC(=O)C5CCC(CC5)N6C(=O)C(C(C6=O)C)C)C)C

Isomeric SMILES

CCCCCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OC(=O)C5CCC(CC5)N6C(=O)C(C(C6=O)C)C)C)C

InChI

InChI=1S/C40H65NO4/c1-7-8-9-10-11-25(2)33-18-19-34-32-17-14-29-24-31(20-22-39(29,5)35(32)21-23-40(33,34)6)45-38(44)28-12-15-30(16-13-28)41-36(42)26(3)27(4)37(41)43/h25-35H,7-24H2,1-6H3