CAS 5415-44-1

1,3,7-Trimethyluric acid

Description:

1,3,7-Trimethyluric acid is a purine derivative characterized by its unique structure, which includes three methyl groups attached to the uric acid backbone. This compound is a product of the metabolism of caffeine and theobromine, both of which are methylxanthines. It is typically found in biological systems and can be involved in various metabolic pathways. The presence of multiple methyl groups contributes to its solubility and reactivity, influencing its biological activity and interactions with enzymes. 1,3,7-Trimethyluric acid is often studied for its potential roles in pharmacology and biochemistry, particularly in relation to its effects on the central nervous system and its implications in conditions like gout and kidney stones. Its CAS number, 5415-44-1, is a unique identifier that facilitates the tracking and study of this compound in scientific literature and databases. Overall, this substance exemplifies the complexity of purine metabolism and its significance in human health.

Formula: C₈H₁₀N₄O₃

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)

InChI key: InChIKey=BYXCFUMGEBZDDI-UHFFFAOYSA-N

SMILES: CN1C2=C(C(=O)N(C)C1=O)N(C)C(=O)N2

Synonyms:

• 1,3,7-Trimethyl-1H-purine-2,6,8(3H,7H,9H)-trione
• 1,3,7-Trimethyl-9H-purine-2,6,8-trione
• 1,3,7-trimethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione
• 1,3,9-trimethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione
• 1H-Purine-2,6,8(3H)-trione, 7,9-dihydro-1,3,7-trimethyl-
• 7,9-Dihydro-1,3,7-trimethyl-1H-purine-2,6,8(3H)-trione
• Ba 2753
• Nsc 11259
• Nsc 95858
• Trimethyl uric acid
• Uric acid, 1,3,7-trimethyl-
• Uric acid, 1,3,7-trimethyl- (VAN)

1H-Purine-2,6,8(3H)-trione,7,9-dihydro-1,3,7-trimethyl-

CAS: 5415-44-1

Formula: C₈H₁₀N₄O₃

Purity: 98%

Color and Shape: Solid

Molecular weight: 210.1900

Ref: IN-DA0037AI

1,3,7-Trimethyluric acid

CAS: 5415-44-1

1,3,7-Trimethyluric acid

Purity: ≥98%

Molecular weight: 210.19g/mol

Ref: 54-BUP11734

1,3,7-Trimethyluric Acid

CAS: 5415-44-1

Formula: C₈H₁₀N₄O₃

Purity: >95.0%(T)(HPLC)

Color and Shape: White to Light yellow powder to crystal

Molecular weight: 210.19

Ref: 3B-T3646

1,3,7-Trimethyluric acid

CAS: 5415-44-1

Formula: C₈H₁₀N₄O₃

Molecular weight: 210.19

Ref: 4Z-U-015005

1,3,7-Trimethyluric acid

CAS: 5415-44-1

1,3,7-Trimethyluric acid: minor caffeine metabolite, antioxidant, scavenges hydroxyl radicals, protects erythrocyte membranes.

Formula: C₈H₁₀N₄O₃

Purity: 99.05% - 99.96%

Color and Shape: Solid

Molecular weight: 210.19

Ref: TM-T19792

1,3,7-Trimethyluric Acid

CAS: 5415-44-1

Applications 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);

Formula: C₈H₁₀N₄O₃

Color and Shape: Light Beige Solid

Molecular weight: 210.19

Ref: TR-T797995