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119137

CGS-21680 hydrochloride hydrate

Name: CGS-21680 hydrochloride hydrate
Brand: MM

≥96% (HPLC), solid, adenosine A2A receptor agonist, Calbiochem^®

Synonym(s):

Adenosine A2A Receptor Agonist I, CGS 21680, Hydrochloride, CGS-21680, CGS21680, 3-(4-(2-((6-amino-9-((2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxytetrahydrofuran-2-yl)-9H-purin-2-yl)amino)ethyl)phenyl)propanoic acid

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About This Item

Empirical Formula (Hill Notation):

C₂₃H₂₉N₇O₆ · xHCl

CAS Number:

124182-57-6

Molecular Weight:

499.52 (free base basis)

MDL number:

MFCD00078573

UNSPSC Code:

12352200

NACRES:

NA.77

Assay:

≥96% (HPLC)

Form:

solid

Storage condition:

OK to freeze, protect from light

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Properties

Product Name

Adenosine A2A Receptor Agonist I, CGS 21680, Hydrochloride,

assay

≥96% (HPLC)

Quality Segment

100

form

solid

manufacturer/tradename

Calbiochem^®

storage condition

OK to freeze, protect from light

color

white

solubility

DMSO: 100 mM

shipped in

ambient

storage temp.

−20°C

SMILES string

[n]2(c3nc(nc(c3nc2)N)NCCc4ccc(cc4)CCC(=O)O)C1O[C@@H]([C@H]([C@H]1O)O)C(=O)NCC

InChI

1S/C23H29N7O6/c1-2-25-21(35)18-16(33)17(34)22(36-18)30-11-27-15-19(24)28-23(29-20(15)30)26-10-9-13-5-3-12(4-6-13)7-8-14(31)32/h3-6,11,16-18,22,33-34H,2,7-10H2,1H3,(H,25,35)(H,31,32)(H3,24,26,28,29)/t16-,17+,18-,22?/m0/s1

InChI key

PAOANWZGLPPROA-OFRRTHGGSA-N

Description

General description

CGS 21680 is a potent adenosine A2A receptors agonist (Ki = 27 nM) and xanthin derivative. CGS 21680 HCl exhibits reduced affinity for A2B receptors (Ki = 67 nM), but offers greater selectivity over A1R (Ki = 290 nM) and A3R (88.8 µM). Exerts an anti-inflammatory effect during chronic inflammation and ameliorates the tissue damage associated with collagen-induced arthritis. Been, shown to reduce CCR7 Protein Expression in THP1 macrophages. Shown to delay the progressive deterioration of motor performance and prevent a reduction in brain weight in murine model of Huntington′s disease.

Features and Benefits

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Digital Titration

ChemiSphere^™ App for Digital Data Transfer to OMNIS Titration Instruments from Metrohm

Discover the ChemiSphere^™ App for secure, rapid data transfer to OMNIS titrators, enhancing efficiency in the titration workflow with Titripur^® and Aquastar^®reagents. ChemiSphere^™ App for Digital Reagent Data Transfer

SmartChemicals for Digital Data Transfer to Mettler Toledo Titration Instruments

Explore digital data transfer with our SmartChemicals for Mettler Toledo titrators—fast, easy, and safe, accelerating the titration process with Titripur^®, Aquastar^® reagents, and Certipur^® and Aquastar^®standards. Supelco^® SmartChemicals for Titration

Packaging

Packaged under inert gas

Physical form

Supplied as a hydrochloride salt.

Preparation Note

Following reconstitution, aliquot and freeze (-20°C). Stock solutions are stable for up to 3 months at -20°C.

Other Notes

The molecular weight of CGS 21680 Hydrochloride this compound is batch-specific due to variable water content. For batch-specific molecular weight information, please refer the vial label or the certificate of analysis. The provided molecular weight represents the baseline molecular weight without water.

Legal Information

AQUASTAR is a registered trademark of Merck KGaA, Darmstadt, Germany

CERTIPUR is a registered trademark of Merck KGaA, Darmstadt, Germany

ChemiSphere is a trademark of Merch KGaA, Darmstadt, Germany

Supelco is a registered trademark of Merck KGaA, Darmstadt, Germany

Titripur is a registered trademark of Merck KGaA, Darmstadt, Germany

CALBIOCHEM is a registered trademark of Merck KGaA, Darmstadt, Germany

Disclaimer

Toxicity: Standard Handling (A)

Storage Class

11 - Combustible Solids

wgk

WGK 2

flash_point_f

Not applicable

flash_point_c