(9,13-dimethyl-3-oxidanylidene-17-propa-1,2-dienyl-2,6,7,8,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl) 3-oxidanylidenebutanoate

Systemtic Name: (9,13-dimethyl-3-oxidanylidene-17-propa-1,2-dienyl-2,6,7,8,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl) 3-oxidanylidenebutanoate Openeye Name: (9,13-dimethyl-3-oxo-17-propa-1,2-dienyl-2,6,7,8,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl) 3-oxobutanoate CAS Name: 3-oxobutanoic acid (9,13-dimethyl-3-oxo-17-propa-1,2-dienyl-2,6,7,8,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl) ester IUPAC Name: (9,13-dimethyl-3-oxo-17-propa-1,2-dienyl-2,6,7,8,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl) 3-oxobutanoate Traditional Name: 3-ketobutyric acid (3-keto-9,13-dimethyl-17-propa-1,2-dienyl-2,6,7,8,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl) ester Formula: C26H34O4 MolecularWeight: 410.54576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OC1(CCC2C1(CCC3(C2CCC4=CC(=O)CCC43)C)C)C=C=C

Isomeric SMILES

CC(=O)CC(=O)OC1(CCC2C1(CCC3(C2CCC4=CC(=O)CCC43)C)C)C=C=C

InChI

InChI=1S/C26H34O4/c1-5-11-26(30-23(29)15-17(2)27)12-10-22-21-8-6-18-16-19(28)7-9-20(18)24(21,3)13-14-25(22,26)4/h11,16,20-22H,1,6-10,12-15H2,2-4H3