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CHEBI:70804 - imidazol-5-ylacetic acid

ChEBI IDCHEBI:70804
ChEBI Nameimidazol-5-ylacetic acid
Stars
DefinitionA monocarboxylic acid that is acetic acid in which one of the methyl hydrogens has been replaced by an imidazol-5-yl group.
Last Modified9 February 2017
Submittermwilliams
DownloadsMolfile
FormulaC5H6N2O2
Net Charge0
Average Mass126.115
Monoisotopic Mass126.04293
SMILESO=C(O)Cc1cncn1
InChIInChI=1S/C5H6N2O2/c8-5(9)1-4-2-6-3-7-4/h2-3H,1H2,(H,6,7)(H,8,9)
InChIKeyPRJKNHOMHKJCEJ-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
imidazol-5-ylacetic acid (CHEBI:70804) has functional parent acetic acid (CHEBI:15366)
imidazol-5-ylacetic acid (CHEBI:70804) has role metabolite (CHEBI:25212)
imidazol-5-ylacetic acid (CHEBI:70804) is a imidazoles (CHEBI:24780)
imidazol-5-ylacetic acid (CHEBI:70804) is a monocarboxylic acid (CHEBI:25384)
imidazol-5-ylacetic acid (CHEBI:70804) is tautomer of 2H-imidazol-4-ylacetic acid (CHEBI:43615)
imidazol-5-ylacetic acid (CHEBI:70804) is tautomer of imidazol-4-ylacetic acid (CHEBI:16974)
Incoming Relation(s)
2H-imidazol-4-ylacetic acid (CHEBI:43615) is tautomer of imidazol-5-ylacetic acid (CHEBI:70804)
imidazol-4-ylacetic acid (CHEBI:16974) is tautomer of imidazol-5-ylacetic acid (CHEBI:70804)
IUPAC Name 
1H-imidazol-5-ylacetic acid
Synonym  Source
2-(1H-imidazole-5-yl)acetic acidChEBI
Manual XrefsDatabases
HMDB0002024HMDB
Registry NumbersSources
Reaxys:607317Reaxys
Citations