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CHEBI:27384 - 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid

ChEBI IDCHEBI:27384
ChEBI Name3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid
Stars
ASCII Name3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid
DefinitionAn imidazol-4-one having a 2-carboxyethyl substituent at the 5-position.
Secondary ChEBI IDsCHEBI:1886, CHEBI:11730, CHEBI:20430, CHEBI:20431
Last Modified27 January 2016
DownloadsMolfile
FormulaC6H8N2O3
Net Charge0
Average Mass156.141
Monoisotopic Mass156.05349
SMILESO=C(O)CCC1NC=NC1=O
InChIInChI=1S/C6H8N2O3/c9-5(10)2-1-4-6(11)8-3-7-4/h3-4H,1-2H2,(H,9,10)(H,7,8,11)
InChIKeyHEXMLHKQVUFYME-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid (CHEBI:27384) has role mouse metabolite (CHEBI:75771)
3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid (CHEBI:27384) is a imidazolone (CHEBI:20432)
3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid (CHEBI:27384) is a monocarboxylic acid (CHEBI:25384)
3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid (CHEBI:27384) is conjugate acid of 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoate(1−) (CHEBI:77893)
3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid (CHEBI:27384) is conjugate acid of 5-(2-carboxylatoethyl)-4-oxo-4,5-dihydro-1H-imidazol-5-ide (CHEBI:57255)
Incoming Relation(s)
3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoate(1−) (CHEBI:77893) is conjugate base of 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid (CHEBI:27384)
5-(2-carboxylatoethyl)-4-oxo-4,5-dihydro-1H-imidazol-5-ide (CHEBI:57255) is conjugate base of 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid (CHEBI:27384)
IUPAC Name 
3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid
Synonyms  Source
4,5-Dihydro-4-oxo-5-imidazolepropanoateKEGG COMPOUND
4,5-Dihydro-5-oxo-1H-imidazole-4-propanoic acidChemIDplus
4-Imidazolone-5-propanoateKEGG COMPOUND
4-Imidazolone-5-propionic acidKEGG COMPOUND
Imidazol-4-one-5-propionic acidChemIDplus
Manual XrefsDatabases
C03680KEGG COMPOUND
Registry NumbersSources
CAS:17340-16-8ChemIDplus