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Nitrogen-15
3-Methyluric acid-2,4,5,6-[13C4],1,3,9-[15N3]

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3-Methyluric acid-2,4,5,6-[13C4],1,3,9-[15N3]

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General Information
Catalog: BLP-005733
CAS: 1173019-10-7
Molecular Formula: [13C]4C2H6[15N]3NO3
Molecular Weight: 189.09

Chemical Structure

Description	3-Methyluric acid-2,4,5,6-[13C4], 1,3,9-[15N3] is intended for use as an internal standard for 3-Methyluric Acid. 3-Methyluric Acid is a methylated derivative of uric acid that inhibits peroxynitrite-mediated oxidation, which has potential therapeutic application in the treatment of multiple sclerosis. 3-Methyluric Acid is also a known metabolite of Caffeine.
Synonyms	3-Methyl-2,6,8-trihydroxypurine-13C4,15N3 (2,4,5,6-13C4, 1,3,9-15N3)
Related CAS	605-99-2 (unlabelled)
Canonical SMILES	CN1C2=C(C(=O)NC1=O)NC(=O)N2
InChI	InChI=1S/C6H6N4O3/c1-10-3-2(7-5(12)8-3)4(11)9-6(10)13/h1H3,(H2,7,8,12)(H,9,11,13)/i2+1,3+1,4+1,6+1,8+1,9+1,10+1
InChI Key	ODCYDGXXCHTFIR-BYSJPOJGSA-N
Melting Point	>300°C
Purity	≥98% by CP; ≥98% atom 13C; ≥98% atom 15N
Appearance	White Solid