[(7R,8R,9S,10R,13S,14S,17S)-7,13,16-trimethyl-3-oxidanylidene-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ethanoate

Systemtic Name: [(7R,8R,9S,10R,13S,14S,17S)-7,13,16-trimethyl-3-oxidanylidene-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ethanoate Openeye Name: [(7R,8R,9S,10R,13S,14S,17S)-7,13,16-trimethyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate CAS Name: acetic acid [(7R,8R,9S,10R,13S,14S,17S)-7,13,16-trimethyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ester IUPAC Name: [(7R,8R,9S,10R,13S,14S,17S)-7,13,16-trimethyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate Traditional Name: acetic acid [(7R,8R,9S,10R,13S,14S,17S)-3-keto-7,13,16-trimethyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ester Formula: C22H32O3 MolecularWeight: 344.48768

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2C3C(CC4=CC(=O)CCC4C3CCC2(C1OC(=O)C)C)C

Isomeric SMILES

C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@@H]3[C@@H]1[C@@H]4CC([C@@H]([C@]4(CC3)C)OC(=O)C)C

InChI

InChI=1S/C22H32O3/c1-12-9-15-11-16(24)5-6-17(15)18-7-8-22(4)19(20(12)18)10-13(2)21(22)25-14(3)23/h11-13,17-21H,5-10H2,1-4H3/t12-,13?,17+,18-,19+,20-,21+,22+/m1/s1