[17-(2-acetyloxyethanoyl)-9-chloranyl-6,10,13,16-tetramethyl-11-oxidanyl-3-oxidanylidene-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate

Systemtic Name: [17-(2-acetyloxyethanoyl)-9-chloranyl-6,10,13,16-tetramethyl-11-oxidanyl-3-oxidanylidene-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate Openeye Name: [17-(2-acetoxyacetyl)-9-chloro-11-hydroxy-6,10,13,16-tetramethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate CAS Name: propanoic acid [17-(2-acetyloxy-1-oxoethyl)-9-chloro-11-hydroxy-6,10,13,16-tetramethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] ester IUPAC Name: [17-(2-acetyloxyacetyl)-9-chloro-11-hydroxy-6,10,13,16-tetramethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate Traditional Name: propionic acid [17-(2-acetoxyacetyl)-9-chloro-11-hydroxy-3-keto-6,10,13,16-tetramethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] ester Formula: C28H37ClO7 MolecularWeight: 521.04218

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1(C(CC2C1(CC(C3(C2CC(C4=CC(=O)C=CC43C)C)Cl)O)C)C)C(=O)COC(=O)C

Isomeric SMILES

CCC(=O)OC1(C(CC2C1(CC(C3(C2CC(C4=CC(=O)C=CC43C)C)Cl)O)C)C)C(=O)COC(=O)C

InChI

InChI=1S/C28H37ClO7/c1-7-24(34)36-28(23(33)14-35-17(4)30)16(3)11-20-21-10-15(2)19-12-18(31)8-9-25(19,5)27(21,29)22(32)13-26(20,28)6/h8-9,12,15-16,20-22,32H,7,10-11,13-14H2,1-6H3