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Product Overview

Product Code

TRC-V095767

Product Format

Neat

Molecular Formula

C25 D9 H22 N5 O3

Molecular Weight

458.601

Product Categories

TRC, Stable isotopes

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

137863-17-3

Product Information

Chemical Data

Analyte Name

Valsartan Methyl Ester-d9

Molecular Formula

C25 D9 H22 N5 O3

Molecular Weight

458.601

Accurate Mass

458.299

SMILES

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)N(Cc1ccc(cc1)c2ccccc2c3nnn[nH]3)[C@@H](C(C)C)C(=O)OC

InChI

InChI=1S/C25H31N5O3/c1-5-6-11-22(31)30(23(17(2)3)25(32)33-4)16-18-12-14-19(15-13-18)20-9-7-8-10-21(20)24-26-28-29-27-24/h7-10,12-15,17,23H,5-6,11,16H2,1-4H3,(H,26,27,28,29)/t23-/m0/s1/i1D3,5D2,6D2,11D2

IUPAC

methyl (2S)-3-methyl-2-[2,2,3,3,4,4,5,5,5-nonadeuteriopentanoyl-[[4-[2-(1H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoate

Unlabelled CAS Number

137863-17-3

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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