4-[9-fluoranyl-10,16-dimethyl-11-oxidanyl-3-oxidanylidene-17-propanoyloxy-17-(2-propanoyloxyethanoyl)-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-13-yl]heptanedioate

Systemtic Name: 4-[9-fluoranyl-10,16-dimethyl-11-oxidanyl-3-oxidanylidene-17-propanoyloxy-17-(2-propanoyloxyethanoyl)-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-13-yl]heptanedioate Openeye Name: 4-[9-fluoro-11-hydroxy-10,16-dimethyl-3-oxo-17-propanoyloxy-17-(2-propanoyloxyacetyl)-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-13-yl]heptanedioate CAS Name: 4-[9-fluoro-11-hydroxy-10,16-dimethyl-3-oxo-17-[1-oxo-2-(1-oxopropoxy)ethyl]-17-(1-oxopropoxy)-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-13-yl]heptanedioate IUPAC Name: 4-[9-fluoro-11-hydroxy-10,16-dimethyl-3-oxo-17-propanoyloxy-17-(2-propanoyloxyacetyl)-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-13-yl]heptanedioate Traditional Name: 4-[9-fluoro-11-hydroxy-3-keto-10,16-dimethyl-17-propionyloxy-17-(2-propionyloxyacetyl)-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-13-yl]pimelate Formula: C34H43FO11-2 MolecularWeight: 646.697023

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C(CCC(=O)[O-])CCC(=O)[O-])C)OC(=O)CC

Isomeric SMILES

CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C(CCC(=O)[O-])CCC(=O)[O-])C)OC(=O)CC

InChI

InChI=1S/C34H45FO11/c1-5-29(43)45-18-26(38)34(46-30(44)6-2)19(3)15-24-23-10-7-21-16-22(36)13-14-31(21,4)33(23,35)25(37)17-32(24,34)20(8-11-27(39)40)9-12-28(41)42/h13-14,16,19-20,23-25,37H,5-12,15,17-18H2,1-4H3,(H,39,40)(H,41,42)/p-2