(10,13-dimethyl-1-oxidanyl-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl) propanoate

Systemtic Name: (10,13-dimethyl-1-oxidanyl-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl) propanoate Openeye Name: (1-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl) propanoate CAS Name: propanoic acid (1-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl) ester IUPAC Name: (1-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl) propanoate Traditional Name: propionic acid (1-hydroxy-3-keto-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl) ester Formula: C22H32O4 MolecularWeight: 360.48708

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1CCC2C1(CCC3C2CCC4=CC(=O)CC(C34C)O)C

Isomeric SMILES

CCC(=O)OC1CCC2C1(CCC3C2CCC4=CC(=O)CC(C34C)O)C

InChI

InChI=1S/C22H32O4/c1-4-20(25)26-19-8-7-16-15-6-5-13-11-14(23)12-18(24)22(13,3)17(15)9-10-21(16,19)2/h11,15-19,24H,4-10,12H2,1-3H3