[9-fluoranyl-10,13,16-trimethyl-17-(2-methylsulfonyloxyethanoyl)-11-oxidanyl-3-oxidanylidene-1,2,4,5,6,7,8,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] benzoate

Systemtic Name: [9-fluoranyl-10,13,16-trimethyl-17-(2-methylsulfonyloxyethanoyl)-11-oxidanyl-3-oxidanylidene-1,2,4,5,6,7,8,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] benzoate Openeye Name: [9-fluoro-11-hydroxy-10,13,16-trimethyl-17-(2-methylsulfonyloxyacetyl)-3-oxo-1,2,4,5,6,7,8,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] benzoate CAS Name: benzoic acid [9-fluoro-11-hydroxy-10,13,16-trimethyl-17-(2-methylsulfonyloxy-1-oxoethyl)-3-oxo-1,2,4,5,6,7,8,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] ester IUPAC Name: [9-fluoro-11-hydroxy-10,13,16-trimethyl-17-(2-methylsulfonyloxyacetyl)-3-oxo-1,2,4,5,6,7,8,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] benzoate Traditional Name: benzoic acid [9-fluoro-11-hydroxy-3-keto-10,13,16-trimethyl-17-(2-methylsulfonyloxyacetyl)-1,2,4,5,6,7,8,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] ester Formula: C30H39FO8S MolecularWeight: 578.689263

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2C3CCC4CC(=O)CCC4(C3(C(CC2(C1(C(=O)COS(=O)(=O)C)OC(=O)C5=CC=CC=C5)C)O)F)C

Isomeric SMILES

CC1CC2C3CCC4CC(=O)CCC4(C3(C(CC2(C1(C(=O)COS(=O)(=O)C)OC(=O)C5=CC=CC=C5)C)O)F)C

InChI

InChI=1S/C30H39FO8S/c1-18-14-23-22-11-10-20-15-21(32)12-13-27(20,2)29(22,31)24(33)16-28(23,3)30(18,25(34)17-38-40(4,36)37)39-26(35)19-8-6-5-7-9-19/h5-9,18,20,22-24,33H,10-17H2,1-4H3