Ezetimibe-d4

Analyte Name

Ezetimibe propyl-phenyl-d4

CAS Number

1093659-89-2

Molecular Formula

C24 D4 H17 F2 N O3

Molecular Weight

413.45

Accurate Mass

413.1741

SMILES

[2H]c1c([2H])c([C@@H](O)CC[C@@H]2[C@H](N(C2=O)c3ccc(F)cc3)c4ccc(O)cc4)c([2H])c([2H])c1F

InChI

InChI=1S/C24H21F2NO3/c25-17-5-1-15(2-6-17)22(29)14-13-21-23(16-3-11-20(28)12-4-16)27(24(21)30)19-9-7-18(26)8-10-19/h1-12,21-23,28-29H,13-14H2/t21-,22+,23-/m1/s1/i1D,2D,5D,6D

IUPAC

(3R,4S)-1-(4-fluorophenyl)-4-(4-hydroxyphenyl)-3-[(3S)-3-hydroxy-3-(2,3,5,6-tetradeuterio-4-fluoro-phenyl)propyl]azetidin-2-one

Unlabelled CAS Number

163222-33-1

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Stable Isotope Labelled

Product Format

Neat

API Family

Ezetimibe

Purity

>95% (HPLC)