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CHEBI:27247 - urocanate

ChEBI IDCHEBI:27247
ChEBI Nameurocanate
Stars
DefinitionAn monocarboxylic acid anion that is the conjugate base of urocanic acid.
Last Modified8 February 2017
DownloadsMolfile
FormulaC6H5N2O2
Net Charge-1
Average Mass137.118
Monoisotopic Mass137.03565
SMILES[H]C(C(=O)[O-])=C([H])c1cncn1
InChIInChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)/p-1
InChIKeyLOIYMIARKYCTBW-UHFFFAOYSA-M
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
urocanate (CHEBI:27247) has role human metabolite (CHEBI:77746)
urocanate (CHEBI:27247) is a monocarboxylic acid anion (CHEBI:35757)
urocanate (CHEBI:27247) is conjugate base of urocanic acid (CHEBI:27248)
Incoming Relation(s)
(E)-thiourocanate thione form (CHEBI:229689) is a urocanate (CHEBI:27247)
Nτ-methyl-trans-urocanate (CHEBI:192561) is a urocanate (CHEBI:27247)
S-methyl-trans-thiourocanate(1−) (CHEBI:229683) is a urocanate (CHEBI:27247)
cis-urocanate (CHEBI:30819) is a urocanate (CHEBI:27247)
trans-urocanate (CHEBI:17771) is a urocanate (CHEBI:27247)
urocanic acid (CHEBI:27248) is conjugate acid of urocanate (CHEBI:27247)
IUPAC Name 
3-(1H-imidazol-4-yl)prop-2-enoate
UniProt Name  Source
urocanateUniProt
Manual XrefsDatabases
C00785KEGG COMPOUND
UROCANATEMetaCyc
ECMDB21396ECMDB