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

Systemtic Name: 3-(6-ethyl-10,13-dimethyl-17-oxidanyl-3-oxidanylidene-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid Openeye Name: 3-(6-ethyl-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid CAS Name: 3-(6-ethyl-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid IUPAC Name: 3-(6-ethyl-17-hydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)propanoic acid Traditional Name: 3-(6-ethyl-17-hydroxy-3-keto-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl)propionic acid Formula: C24H36O4 MolecularWeight: 388.54024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC2C(CCC3(C2CCC3(CCC(=O)O)O)C)C4(C1=CC(=O)CC4)C

Isomeric SMILES

CCC1CC2C(CCC3(C2CCC3(CCC(=O)O)O)C)C4(C1=CC(=O)CC4)C

InChI

InChI=1S/C24H36O4/c1-4-15-13-17-18(22(2)9-5-16(25)14-20(15)22)6-10-23(3)19(17)7-11-24(23,28)12-8-21(26)27/h14-15,17-19,28H,4-13H2,1-3H3,(H,26,27)