[2-(17-carboxyoxy-6,10,13-trimethyl-11-oxidanyl-3-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxidanylidene-ethyl] ethanoate

Systemtic Name: [2-(17-carboxyoxy-6,10,13-trimethyl-11-oxidanyl-3-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxidanylidene-ethyl] ethanoate Openeye Name: [2-(17-carboxyoxy-11-hydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxo-ethyl] acetate CAS Name: acetic acid [2-(17-carboxyoxy-11-hydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] ester IUPAC Name: [2-(17-carboxyoxy-11-hydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate Traditional Name: acetic acid [2-(17-carboxyoxy-11-hydroxy-3-keto-6,10,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-keto-ethyl] ester Formula: C25H32O8 MolecularWeight: 460.51678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2C3CCC(C3(CC(C2C4(C1=CC(=O)C=C4)C)O)C)(C(=O)COC(=O)C)OC(=O)O

Isomeric SMILES

CC1CC2C3CCC(C3(CC(C2C4(C1=CC(=O)C=C4)C)O)C)(C(=O)COC(=O)C)OC(=O)O

InChI

InChI=1S/C25H32O8/c1-13-9-16-17-6-8-25(33-22(30)31,20(29)12-32-14(2)26)24(17,4)11-19(28)21(16)23(3)7-5-15(27)10-18(13)23/h5,7,10,13,16-17,19,21,28H,6,8-9,11-12H2,1-4H3,(H,30,31)