Analyte Name

Canagliflozin-(4-Fluorophenyl)-d4

Molecular Formula

C24 D4 H21 F O5 S

Molecular Weight

448.54

Accurate Mass

448.166

SMILES

[2H]c1c([2H])c(c([2H])c([2H])c1F)c2ccc(Cc3cc(ccc3C)[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)s2

InChI

InChI=1S/C24H25FO5S/c1-13-2-3-15(24-23(29)22(28)21(27)19(12-26)30-24)10-16(13)11-18-8-9-20(31-18)14-4-6-17(25)7-5-14/h2-10,19,21-24,26-29H,11-12H2,1H3/t19-,21-,22+,23-,24+/m1/s1/i4D,5D,6D,7D

IUPAC

(2R,3S,4R,5R,6S)-2-(hydroxymethyl)-6-[4-methyl-3-[[5-(2,3,5,6-tetradeuterio-4-fluorophenyl)thiophen-2-yl]methyl]phenyl]oxane-3,4,5-triol

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat