Product Information
Name:1,3,7-Trimethyluric Acid-d9
Controlled Product
Synonyms:
- Ba 2753-d9
- NSC 11259-d9
- NSC 95858-d9
- 1,3,7-Trimethyl Uric Acid-d9
- 7,9-Dihydro-1,3,7-trimethyl-1H-purine-2,6,8(3H)-trione-d9
Brand:TRC
Description:Applications 1,3,7-Trimethyluric Acid-d9 is an isotope labelled analog of 1,3,7-Trimethyluric Acid. 1,3,7-Trimethyluric Acid is a caffeine derivative, and a methyl derivative of uric acid. Detected as a urine marker of caffeine consumption.References Rothwell, J. et al.: PLoS One, 9, e93474 (2014); Silva, C. et al.: Sci. Trans. Med., 5, 197ra04 (2013);
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Chemical properties
Molecular weight:219.245
Formula:C8D9HN4O3
Color/Form:Neat
InChI:InChI=1S/C8H10N4O3/c1-10-4-5(9-7(10)14)11(2)8(15)12(3)6(4)13/h1-3H3,(H,9,14)/i1D3,2D3,3D3
InChI key:InChIKey=BYXCFUMGEBZDDI-GQALSZNTSA-N
SMILES:[2H]C([2H])([2H])n1c(=O)c2c([nH]c(=O)n2C([2H])([2H])[2H])n(C([2H])([2H])[2H])c1=O
Technical inquiry about: 1,3,7-Trimethyluric Acid-d9
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