Crystal Structure of Canagliflozin

Id2241659
Common namecanagliflozin
Chemical name(2<i>S</i>,3<i>R</i>,4<i>R</i>,5<i>S</i>,6<i>R</i>)-2-(3-{[5-(4-Fluorophenyl)thiophen-2-yl]methyl}-4-methylphenyl)-6-(hydroxymethyl)-3,4,5,6-tetrahydro-2<i>H</i>-pyran-3,4,5-triol hemihydrate
a (Å)8.4259(4)
b (Å)11.4264(7)
c (Å)45.706(2)
α (°)90.00
β (°)90.00
γ (°)90.00
V (Å3)4400.5(4)
Space groupP 21 21 21
Temperature (K)296(2)
Rint0.0800
Publication: Acta Crystallographica Section E (2016) 72, 5 734-736