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Product Overview

Product Code

TRC-A597845

Product Format

Neat

Molecular Formula

C25 H40 N6 O5 S

Molecular Weight

536.687

API Family

Argatroban

Product Categories

TRC, Impurity Reference Materials

Documentation

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Product Information

Chemical Data

Analyte Name

Argatroban Ethyl Ester

Molecular Formula

C25 H40 N6 O5 S

Molecular Weight

536.687

Accurate Mass

536.278

SMILES

CCOC(=O)[C@H]1C[C@H](C)CCN1C(=O)[C@H](CCCNC(=N)N)NS(=O)(=O)c2cccc3CC(C)CNc23

InChI

InChI=1S/C25H40N6O5S/c1-4-36-24(33)20-14-16(2)10-12-31(20)23(32)19(8-6-11-28-25(26)27)30-37(34,35)21-9-5-7-18-13-17(3)15-29-22(18)21/h5,7,9,16-17,19-20,29-30H,4,6,8,10-15H2,1-3H3,(H4,26,27,28)/t16-,17?,19+,20-/m1/s1

IUPAC

ethyl (2R,4R)-1-[(2S)-5-carbamimidamido-2-[(3-methyl-1,2,3,4-tetrahydroquinolin-8-yl)sulfonylamino]pentanoyl]-4-methylpiperidine-2-carboxylate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Argatroban

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