3,7-dimethyluric acid (CHEBI:68531)

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ChEBI Name	3,7-dimethyluric acid

ChEBI ID	CHEBI:68531

Definition	An oxopurine that is 7,9-dihydro-1H-purine-2,6,8(3H)-trione substituted by methyl groups at N-3 and N-7.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C7H8N4O3

Net Charge

Average Mass

196.16340

Monoisotopic Mass

196.05964

InChI

InChI=1S/C7H8N4O3/c1-10-3-4(8-6(10)13)11(2)7(14)9-5(3)12/h1-2H3,(H,8,13)(H,9,12,14)

InChIKey

HMLZLHKHNBLLJD-UHFFFAOYSA-N

SMILES

Cn1c2[nH]c(=O)n(C)c2c(=O)[nH]c1=O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Source: BioModels - MODEL1507180067 See: PubMed

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).

ChEBI Ontology
Outgoing	3,7-dimethyluric acid (CHEBI:68531) has functional parent 7,9-dihydro-1H-purine-2,6,8(3H)-trione (CHEBI:17775) 3,7-dimethyluric acid (CHEBI:68531) has role metabolite (CHEBI:25212) 3,7-dimethyluric acid (CHEBI:68531) has role mouse metabolite (CHEBI:75771) 3,7-dimethyluric acid (CHEBI:68531) is a oxopurine (CHEBI:25810) 3,7-dimethyluric acid (CHEBI:68531) is conjugate acid of 3,7-dimethylurate anion (CHEBI:133728)

Incoming	3,7-dimethylurate anion (CHEBI:133728) is conjugate base of 3,7-dimethyluric acid (CHEBI:68531)

IUPAC Name

3,7-dimethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione

Synonym	Source
3,7-dimethylurate	UniProt

Citation	Type	Source
22770225	PubMed citation	Europe PMC

Last Modified

15 September 2023