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1609563-71-4

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1609563-71-4 Structure

1609563-71-4 Structure
IdentificationBack Directory
[Name]

(1R,2R)-2-PCCA(hydrochloride)
[CAS]

1609563-71-4
[Synonyms]

(1R,2R)-2-PCCA(hydrochloride)
[Molecular Formula]

C30H38ClN3O
[MOL File]

1609563-71-4.mol
[Molecular Weight]

492.1
Chemical PropertiesBack Directory
[storage temp. ]

Inert atmosphere,2-8°C
[solubility ]

DMSO : 50 mg/mL (94.60 mM)
[form ]

Solid
[color ]

Light yellow to khaki
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Uses]

(1R,2R)-2-PCCA hydrochloride is a diastereomer of 2-PCCA, and acts as a potent GPR88 receptor agonist, with an EC50 of 3 nM in cell-free assay, and 603 nM in cell assay.
[storage]

Store at -20°C
[References]

[1] Bi, Yingzhi, et al. Modulators of G Protein-Coupled Receptor 88. US 20110251204 A1.
[2] Jin C, et al. Synthesis, pharmacological characterization, and structure-activity relationship studies of small molecular agonists for the orphan GPR88 receptor. ACS Chem Neurosci. 2014 Jul 16;5(7):576-87. DOI:10.1021/cn500082p
[3] Jin C, et al. Effect of Substitution on the Aniline Moiety of the GPR88 Agonist 2-PCCA: Synthesis, Structure-Activity Relationships, and Molecular Modeling Studies. ACS Chem Neurosci. 2016 Oct 19;7(10):1418-1432. DOI:10.1021/acschemneuro.6b00182
Spectrum DetailBack Directory
[Spectrum Detail]

(1R,2R)-2-PCCA(hydrochloride)(1609563-71-4)1HNMR
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