[1-acetyloxy-17-(3-methoxy-6-methyl-6-oxidanyl-heptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate

Systemtic Name: [1-acetyloxy-17-(3-methoxy-6-methyl-6-oxidanyl-heptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate Openeye Name: [1-acetoxy-17-(5-hydroxy-2-methoxy-1,5-dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate CAS Name: acetic acid [1-acetyloxy-17-(6-hydroxy-3-methoxy-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [1-acetyloxy-17-(6-hydroxy-3-methoxy-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate Traditional Name: acetic acid [1-acetoxy-17-(5-hydroxy-2-methoxy-1,5-dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester Formula: C32H52O6 MolecularWeight: 532.75168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCC2C1(CCC3C2CC=C4C3(C(CC(C4)OC(=O)C)OC(=O)C)C)C)C(CCC(C)(C)O)OC

Isomeric SMILES

CC(C1CCC2C1(CCC3C2CC=C4C3(C(CC(C4)OC(=O)C)OC(=O)C)C)C)C(CCC(C)(C)O)OC

InChI

InChI=1S/C32H52O6/c1-19(28(36-8)14-15-30(4,5)35)25-11-12-26-24-10-9-22-17-23(37-20(2)33)18-29(38-21(3)34)32(22,7)27(24)13-16-31(25,26)6/h9,19,23-29,35H,10-18H2,1-8H3