10,13-dimethyl-17-(6-methylheptan-2-yl)-3-[(2-methylpropan-2-yl)oxy]-5,6-bis(oxidanyl)-2,3,4,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-one

Systemtic Name: 10,13-dimethyl-17-(6-methylheptan-2-yl)-3-[(2-methylpropan-2-yl)oxy]-5,6-bis(oxidanyl)-2,3,4,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-one Openeye Name: 3-tert-butoxy-17-(1,5-dimethylhexyl)-5,6-dihydroxy-10,13-dimethyl-2,3,4,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-one CAS Name: 5,6-dihydroxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-3-[(2-methylpropan-2-yl)oxy]-2,3,4,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-one IUPAC Name: 5,6-dihydroxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-3-[(2-methylpropan-2-yl)oxy]-2,3,4,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-one Traditional Name: 3-tert-butoxy-17-(1,5-dimethylhexyl)-5,6-dihydroxy-10,13-dimethyl-2,3,4,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7-one Formula: C31H54O4 MolecularWeight: 490.75806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2C(=O)C(C4(C3(CCC(C4)OC(C)(C)C)C)O)O)C

Isomeric SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2C(=O)C(C4(C3(CCC(C4)OC(C)(C)C)C)O)O)C

InChI

InChI=1S/C31H54O4/c1-19(2)10-9-11-20(3)22-12-13-23-25-24(15-16-29(22,23)7)30(8)17-14-21(35-28(4,5)6)18-31(30,34)27(33)26(25)32/h19-25,27,33-34H,9-18H2,1-8H3