Name: Argatroban monohydrate
Brand: TRC
SKU: TRC-A769005-100MG

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Product Overview

Product Code

TRC-A769005-100MG

CAS Number

141396-28-3

Product Format

Neat

Molecular Formula

C23 H36 N6 O5 S . H2 O

Molecular Weight

526.65

API Family

Argatroban

Product Categories

TRC, API Reference Standards & Research Materials, Building Blocks

Product Type

API, Synthesis tool

Documentation

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Product Information

Analyte Name

Argatroban Monohydrate

CAS Number

141396-28-3

Molecular Formula

C23 H36 N6 O5 S . H2 O

Molecular Weight

526.65

Accurate Mass

526.2574

SMILES

O.C[C@@H]1CCN([C@H](C1)C(=O)O)C(=O)[C@H](CCCNC(=N)N)NS(=O)(=O)c2cccc3CC(C)CNc23

InChI

InChI=1S/C23H36N6O5S.H2O/c1-14-8-10-29(18(12-14)22(31)32)21(30)17(6-4-9-26-23(24)25)28-35(33,34)19-7-3-5-16-11-15(2)13-27-20(16)19;/h3,5,7,14-15,17-18,27-28H,4,6,8-13H2,1-2H3,(H,31,32)(H4,24,25,26);1H2/t14-,15?,17+,18-;/m1./s1

IUPAC

(2R,4R)-1-[(2S)-5-carbamimidamido-2-[(3-methyl-1,2,3,4-tetrahydroquinolin-8-yl)sulfonylamino]pentanoyl]-4-methylpiperidine-2-carboxylic acid;hydrate

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Synthesis tool

Product Format

Neat

API Family

Argatroban

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