5-Aminosalicylic Acid-d3 hydrochloride

For research use only. Not for therapeutic Use.

  • CAT Number: R072175
  • CAS Number: 1346601-18-0
  • Molecular Formula: C7H5D3ClNO3
  • Molecular Weight: 192.61
  • Purity: ≥95%
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5-Aminosalicylic Acid-d3 (hydrochloride) is the deuterium labeled 5-Aminosalicylic Acid. 5-Aminosalicylic acid (Mesalamine) hydrochloride acts as a specific PPARγ agonist and also inhibits p21-activated kinase 1 (PAK1) and NF-κB.
Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].


Catalog Number R072175
CAS Number 1346601-18-0
Synonyms

3-amino-2,4,5-trideuterio-6-hydroxybenzoic acid;hydrochloride

Molecular Formula C7H5D3ClNO3
Purity ≥95%
InChI InChI=1S/C7H7NO3.ClH/c8-4-1-2-6(9)5(3-4)7(10)11;/h1-3,9H,8H2,(H,10,11);1H/i1D,2D,3D;
InChIKey KKRSNTURHSOKTM-KADUPEOVSA-N
SMILES C1=CC(=C(C=C1N)C(=O)O)O.Cl
Reference

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216.
 [Content Brief]

[2]. Dammann K, et al. PAK1 modulates a PPARγ/NF-κB cascade in intestinal inflammation. Biochim Biophys Acta. 2015 Oct;1853(10 Pt A):2349-60.;Fang HM, et al. 5-aminosalicylic acid in combination with Nimesulide inhibits proliferation of colon carcinoma cells in vitro. World J Gastroenterol. 2007 May 28;13(20):2872-7.;Rousseaux C, et al. The 5-aminosalicylic acid antineoplastic effect in the intestine is mediated by PPARγ. Carcinogenesis. 2013 Nov;34(11):2580-6.
 [Content Brief]

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