imidazol-1-ylacetic acid (CHEBI:70801)

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ChEBI Name	imidazol-1-ylacetic acid

ChEBI ID	CHEBI:70801

Definition	An imidazolyl carboxylic acid that is acetic acid in which one of the methyl hydrogens is substituted by an imidazol-1-yl group.

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

Supplier Information	ChemicalBook:CB0675060, eMolecules:707688, ZINC000019735340

Download	Molfile XML SDF

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Formula

C5H6N2O2

Net Charge

Average Mass

126.114

Monoisotopic Mass

126.04293

InChI

InChI=1S/C5H6N2O2/c8-5(9)3-7-2-1-6-4-7/h1-2,4H,3H2,(H,8,9)

InChIKey

QAFBDRSXXHEXGB-UHFFFAOYSA-N

SMILES

C1=CN(CC(=O)O)C=N1

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.

ChEBI Ontology
Outgoing	imidazol-1-ylacetic acid (CHEBI:70801) has functional parent acetic acid (CHEBI:15366) imidazol-1-ylacetic acid (CHEBI:70801) has role metabolite (CHEBI:25212) imidazol-1-ylacetic acid (CHEBI:70801) is a imidazolyl carboxylic acid (CHEBI:38307)

IUPAC Name

1H-imidazol-1-ylacetic acid

Synonym	Source
2-(imidazol-1-yl)acetic acid	ChEBI

Registry Number	Type	Source
112120	Reaxys Registry Number	Reaxys

Citation

Last Modified

05 March 2020