CHEBI:70804 - imidazol-5-ylacetic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name imidazol-5-ylacetic acid
Definition A monocarboxylic acid that is acetic acid in which one of the methyl hydrogens has been replaced by an imidazol-5-yl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C5H6N2O2
Net Charge 0
Average Mass 126.11330
Monoisotopic Mass 126.04293
InChI InChI=1S/C5H6N2O2/c8-5(9)1-4-2-6-3-7-4/h2-3H,1H2,(H,6,7)(H,8,9)
SMILES OC(=O)Cc1cnc[nH]1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 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)
1H-imidazol-5-ylacetic acid
Synonym Source
2-(1H-imidazole-5-yl)acetic acid ChEBI
Manual Xref Database
HMDB0002024 HMDB
View more database links
Registry Number Type Source
607317 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22770225 PubMed citation Europe PMC
Last Modified
09 February 2017