CHEBI:27247 - urocanate

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ChEBI Name urocanate
ChEBI ID CHEBI:27247
Definition An monocarboxylic acid anion that is the conjugate base of urocanic acid.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C6H5N2O2
Net Charge -1
Average Mass 137.11618
Monoisotopic Mass 137.03565
InChI InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)/p-1
InChIKey LOIYMIARKYCTBW-UHFFFAOYSA-M
SMILES [H]C(=C([H])c1c[nH]cn1)C([O-])=O
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
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ChEBI Ontology
Outgoing 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 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
Synonym Source
urocanate UniProt
Manual Xrefs Databases
C00785 KEGG COMPOUND
ECMDB21396 ECMDB
UROCANATE MetaCyc
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Last Modified
08 February 2017