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3’’’-Epi-Empagliflozin-d4

Product Specifications

Synonyms

(1S)-1,5-Anhydro-1-C-[4-chloro-3-[[4-[[(3R)-tetrahydro-3-furanyl]oxy]phenyl]methyl]phenyl]-D-glucitol-d4; Empagliflozin Impurity C-d4

Hazard Statement

No Data Available

Smiles

OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)C2=CC(CC3=CC=C(C=C3)O[C@H]4C([2H])(OC([2H])(C4)[2H])[2H])=C(C=C2)Cl

Molecular Formula

C23H23D4ClO7

Molecular Weight

454.93

InChI

InChI=1S/C23H27ClO7/c24-18-6-3-14(23-22(28)21(27)20(26)19(11-25)31-23)10-15(18)9-13-1-4-16(5-2-13)30-17-7-8-29-12-17/h1-6,10,17,19-23,25-28H,7-9,11-12H2/t17-,19-,20-,21+,22-,23+/m1/s1/i8D2,12D2

Additionnal Information

IUPAC name: (2S,3R,4R,5S,6R)-2-(4-chloro-3-(4-(((R)-tetrahydrofuran-3-yl-2,2,5,5-d4)oxy)benzyl)phenyl)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol