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Product Overview

Product Code

TRC-E767600

Product Format

Neat

Molecular Formula

C19 H30 N5 O5 S . Na

Molecular Weight

463.53

Product Categories

TRC, Impurity Reference Materials

Alternate CAS Number

767625-11-6

Documentation

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Product Information

Chemical Data

Analyte Name

4S-Des-3-chloropyridine Edoxaban Sodium Salt

Molecular Formula

C19 H30 N5 O5 S . Na

Molecular Weight

463.53

Accurate Mass

463.1865

SMILES

[Na+].CN(C)C(=O)[C@H]1CC[C@H](NC(=O)C(=O)[O-])[C@@H](C1)NC(=O)C2NC3CCN(C)CC3S2

InChI

InChI=1S/C19H31N5O5S.Na/c1-23(2)18(27)10-4-5-11(20-16(26)19(28)29)13(8-10)21-15(25)17-22-12-6-7-24(3)9-14(12)30-17;/h10-14,17,22H,4-9H2,1-3H3,(H,20,26)(H,21,25)(H,28,29);/q;+1/p-1/t10-,11-,12?,13+,14?,17?;/m0./s1

IUPAC

sodium;2-[[(1S,2R,4S)-4-(dimethylcarbamoyl)-2-[(5-methyl-2,3a,4,6,7,7a-hexahydro-1H-thiazolo[5,4-c]pyridine-2-carbonyl)amino]cyclohexyl]amino]-2-oxo-acetate

Alternate CAS Number

767625-11-6

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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