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> Main
CHEBI:70966 - 1-methyl-5-imidazoleacetic acid
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ChEBI Name
1-methyl-5-imidazoleacetic acid
ChEBI ID
CHEBI:70966
Definition
An imidazolyl carboxylic acid that is acetic acid in which one of the methyl hydrogens is substituted by a 1-methylimidazol-5-yl group.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
No supplier information found for this compound.
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Formula
C6H8N2O2
Net Charge
0
Average Mass
140.140
Monoisotopic Mass
140.05858
InChI
InChI=1S/C6H8N2O2/c1-8-4-7-3-5(8)2-6(9)10/h3-4H,2H2,1H3,(H,9,10)
InChIKey
UJCGYTCAMOHYCG-UHFFFAOYSA-N
SMILES
N1=CN(C(=C1)CC(=O)O)C
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted 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
1-methyl-5-imidazoleacetic acid (
CHEBI:70966
)
has role
metabolite (
CHEBI:25212
)
1-methyl-5-imidazoleacetic acid (
CHEBI:70966
)
is a
imidazolyl carboxylic acid (
CHEBI:38307
)
IUPAC Name
(1-methyl-1
H
-imidazol-5-yl)acetic acid
Synonyms
Sources
1-methyl-Imidazole-5-acetic acid
HMDB
Π-Methylimidazoleacetic acid
HMDB
Pros-methylimidazoleacetic acid
ChemIDplus
Manual Xref
Database
HMDB0004988
HMDB
View more database links
Registry Numbers
Types
Sources
120665
Reaxys Registry Number
Reaxys
4200-48-0
CAS Registry Number
ChemIDplus
Citations
Last Modified
08 February 2017