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CHEBI:28474 - γ-amino-γ-cyanobutanoic acid

ChEBI IDCHEBI:28474
ChEBI Nameγ-amino-γ-cyanobutanoic acid
Stars
ASCII Namegamma-amino-gamma-cyanobutanoic acid
DefinitionA γ-amino acid that is GABA in which one of the hydrogens at position 4 is replaced by a cyano group.
Secondary ChEBI IDsCHEBI:10558, CHEBI:24187
Last Modified1 May 2015
DownloadsMolfile
FormulaC5H8N2O2
Net Charge0
Average Mass128.131
Monoisotopic Mass128.05858
SMILESN#CC(N)CCC(=O)O
InChIInChI=1S/C5H8N2O2/c6-3-4(7)1-2-5(8)9/h4H,1-2,7H2,(H,8,9)
InChIKeyDXWQLTOXWVWMOH-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
γ-amino-γ-cyanobutanoic acid (CHEBI:28474) has functional parent butyric acid (CHEBI:30772)
γ-amino-γ-cyanobutanoic acid (CHEBI:28474) is a aliphatic nitrile (CHEBI:80291)
γ-amino-γ-cyanobutanoic acid (CHEBI:28474) is a monocarboxylic acid (CHEBI:25384)
γ-amino-γ-cyanobutanoic acid (CHEBI:28474) is a γ-amino acid (CHEBI:33707)
Incoming Relation(s)
(R)-γ-amino-γ-cyanobutanoic acid (CHEBI:50615) is a γ-amino-γ-cyanobutanoic acid (CHEBI:28474)
(S)-γ-amino-γ-cyanobutanoic acid (CHEBI:50614) is a γ-amino-γ-cyanobutanoic acid (CHEBI:28474)
IUPAC Name 
4-amino-4-cyanobutanoic acid
Synonyms  Source
gamma-Amino-gamma-cyanobutanoateKEGG COMPOUND
4-Amino-4-cyanobutanoic acidKEGG COMPOUND
4-amino-4-cyanobutyric acidChemIDplus
Manual XrefsDatabases
C05715KEGG COMPOUND
LMFA01100037LIPID MAPS
Registry NumbersSources
Beilstein:2960649Beilstein
CAS:14046-56-1ChemIDplus