CHEBI:28092 - γ-glutamyl-β-aminopropiononitrile

ChEBI IDCHEBI:28092
ChEBI Nameγ-glutamyl-β-aminopropiononitrile
Stars
ASCII Namegamma-glutamyl-beta-aminopropiononitrile
DefinitionA nitrile that is L-glutamine in which one of the hydrogens attached to the amide nitrogen is replaced by a 2-cyanoethyl group.
Secondary ChEBI IDsCHEBI:10564, CHEBI:24192
Last Modified7 March 2018
DownloadsMolfile
FormulaC8H13N3O3
Net Charge0
Average Mass199.210
Monoisotopic Mass199.09569
SMILESN#CCCNC(=O)CC[C@H](N)C(=O)O
InChIInChI=1S/C8H13N3O3/c9-4-1-5-11-7(12)3-2-6(10)8(13)14/h6H,1-3,5,10H2,(H,11,12)(H,13,14)/t6-/m0/s1
InChIKeyVQPVVWAFTIFKDD-LURJTMIESA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
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)
γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) has functional parent β-aminopropionitrile (CHEBI:27413)
γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) has role mouse metabolite (CHEBI:75771)
γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) is a L-glutamine derivative (CHEBI:24317)
γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) is a aliphatic nitrile (CHEBI:80291)
γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
γ-glutamyl-β-aminopropiononitrile (CHEBI:28092) is a secondary carboxamide (CHEBI:140325)
IUPAC Name 
N-(2-cyanoethyl)-L-glutamine
Synonyms  Source
gamma-Glutamyl-beta-aminopropiononitrileKEGG COMPOUND
gamma-Glutamyl-3-aminopropiononitrileKEGG COMPOUND
Manual XrefsDatabases
C06114KEGG COMPOUND
Registry NumbersSources
Reaxys:1727448Reaxys