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Product Overview

Product Code

TRC-S491005

Product Format

Neat

Molecular Formula

C16H15F6NaN5O4S

Molecular Weight

509.36

API Family

Sitagliptin

Product Categories

TRC, Additional pharmaceutical toxicology reference materials, Additional pharmaceutical toxicology reference materials, Pharmaceutical Reference Standards, Impurity Reference Materials , Additional pharmaceutical toxicology research materials

Product Type

Metabolite

Alternate CAS Number

Free acid: 940002-57-3

Documentation

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Product Information

Chemical Data

Analyte Name

Sitagliptin N-Sulfate Sodium Salt

Molecular Formula

C16H15F6NaN5O4S

Molecular Weight

509.36

SMILES

FC1=CC(C[C@@H](NS(=O)(O[Na])=O)CC(N2CCN3C(C2)=NN=C3C(F)(F)F)=O)=C(F)C=C1F

InChI

InChI=1S/C16H15F6N5O4S.Na/c17-10-6-12(19)11(18)4-8(10)3-9(25-32(29,30)31)5-14(28)26-1-2-27-13(7-26)23-24-15(27)16(20,21)22;/h4,6,9,25H,1-3,5,7H2,(H,29,30,31);/q;+1/p-1/t9-;/m1./s1

Alternate CAS Number

Free acid: 940002-57-3

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Sitagliptin

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