(2E)-2-(1,10,13-trimethyl-3-oxidanylidene-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ylidene)propanoate

Systemtic Name: (2E)-2-(1,10,13-trimethyl-3-oxidanylidene-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ylidene)propanoate Openeye Name: (2E)-2-(1,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ylidene)propanoate CAS Name: (2E)-2-(1,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ylidene)propanoate IUPAC Name: (2E)-2-(1,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ylidene)propanoate Traditional Name: (2E)-2-(3-keto-1,10,13-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-ylidene)propionate Formula: C23H31O3- MolecularWeight: 355.49044

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C=C2C1(C3CCC4(C(C3CC2)CCC4=C(C)C(=O)[O-])C)C

Isomeric SMILES

CC1CC(=O)C=C2C1(C3CCC\4(C(C3CC2)CC/C4=C(/C)\C(=O)[O-])C)C

InChI

InChI=1S/C23H32O3/c1-13-11-16(24)12-15-5-6-17-19-8-7-18(14(2)21(25)26)22(19,3)10-9-20(17)23(13,15)4/h12-13,17,19-20H,5-11H2,1-4H3,(H,25,26)/p-1/b18-14+