[(13S,14R)-13-methyl-14-oxidanyl-17-oxidanylidene-11,12,15,16-tetrahydrocyclopenta[a]phenanthren-3-yl] ethanoate

Systemtic Name: [(13S,14R)-13-methyl-14-oxidanyl-17-oxidanylidene-11,12,15,16-tetrahydrocyclopenta[a]phenanthren-3-yl] ethanoate Openeye Name: [(13S,14R)-14-hydroxy-13-methyl-17-oxo-11,12,15,16-tetrahydrocyclopenta[a]phenanthren-3-yl] acetate CAS Name: acetic acid [(13S,14R)-14-hydroxy-13-methyl-17-oxo-11,12,15,16-tetrahydrocyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [(13S,14R)-14-hydroxy-13-methyl-17-oxo-11,12,15,16-tetrahydrocyclopenta[a]phenanthren-3-yl] acetate Traditional Name: acetic acid [(13S,14R)-14-hydroxy-17-keto-13-methyl-11,12,15,16-tetrahydrocyclopenta[a]phenanthren-3-yl] ester Formula: C20H20O4 MolecularWeight: 324.3704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)C3=C(C=C2)C4(CCC(=O)C4(CC3)C)O

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)C3=C(C=C2)[C@@]4(CCC(=O)[C@]4(CC3)C)O

InChI

InChI=1S/C20H20O4/c1-12(21)24-14-4-5-15-13(11-14)3-6-17-16(15)7-9-19(2)18(22)8-10-20(17,19)23/h3-6,11,23H,7-10H2,1-2H3/t19-,20-/m1/s1