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CHEBI:73685 - N2-acetylglutamine

ChEBI IDCHEBI:73685
ChEBI NameN2-acetylglutamine
Stars
ASCII NameN(2)-acetylglutamine
DefinitionA glutamine derivative with an acetyl group bound at the α-amino group.
Last Modified6 August 2019
Submittermwilliams
DownloadsMolfile
FormulaC7H12N2O4
Net Charge0
Average Mass188.183
Monoisotopic Mass188.07971
SMILESCC(=O)NC(CCC(N)=O)C(=O)O
InChIInChI=1S/C7H12N2O4/c1-4(10)9-5(7(12)13)2-3-6(8)11/h5H,2-3H2,1H3,(H2,8,11)(H,9,10)(H,12,13)
InChIKeyKSMRODHGGIIXDV-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
human urinary metabolite  Any metabolite (endogenous or exogenous) found in human urine samples.
ChEBI Ontology
Outgoing Relation(s)
N2-acetylglutamine (CHEBI:73685) has role human urinary metabolite (CHEBI:84087)
N2-acetylglutamine (CHEBI:73685) is a N-acetyl-amino acid (CHEBI:21575)
N2-acetylglutamine (CHEBI:73685) is a N2-acylglutamine (CHEBI:83985)
Incoming Relation(s)
N-acetyl-L-glutamine (CHEBI:21553) is a N2-acetylglutamine (CHEBI:73685)
N2-acetyl-D-glutamine (CHEBI:144430) is a N2-acetylglutamine (CHEBI:73685)
IUPAC Names 
N2-acetylglutamine
2-(acetylamino)-5-amino-5-oxopentanoic acid
Synonyms  Source
AcetylglutamineHMDB
N-AcetylglutamineHMDB
Aceglutamide [INN]ChemIDplus
GlcNAcChEBI
Manual XrefsDatabases
HMDB0006029HMDB
Registry NumbersSources
Reaxys:1727470Reaxys
CAS:2490-97-3ChemIDplus