(8S,9S,10R,11S,13S,14S,17R)-1-fluoranyl-10,13-dimethyl-11,17-bis(oxidanyl)-17-(2-oxidanylethanoyl)-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one

Systemtic Name: (8S,9S,10R,11S,13S,14S,17R)-1-fluoranyl-10,13-dimethyl-11,17-bis(oxidanyl)-17-(2-oxidanylethanoyl)-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one Openeye Name: (8S,9S,10R,11S,13S,14S,17R)-1-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one CAS Name: (8S,9S,10R,11S,13S,14S,17R)-1-fluoro-11,17-dihydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one IUPAC Name: (8S,9S,10R,11S,13S,14S,17R)-1-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one Traditional Name: (8S,9S,10R,11S,13S,14S,17R)-1-fluoro-17-glycoloyl-11,17-dihydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one Formula: C21H29FO5 MolecularWeight: 380.450363

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(C3C(C1CCC2(C(=O)CO)O)CCC4=CC(=O)CC(C34C)F)O

Isomeric SMILES

C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)CCC4=CC(=O)CC([C@]34C)F)O

InChI

InChI=1S/C21H29FO5/c1-19-9-15(25)18-13(14(19)5-6-21(19,27)17(26)10-23)4-3-11-7-12(24)8-16(22)20(11,18)2/h7,13-16,18,23,25,27H,3-6,8-10H2,1-2H3/t13-,14-,15-,16?,18+,19-,20+,21-/m0/s1