EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:165543 - N-Oleoyl GABA

ChEBI IDCHEBI:165543
ChEBI NameN-Oleoyl GABA
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H41NO3
Net Charge0
Average Mass367.574
Monoisotopic Mass367.30864
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)NCCCC(=O)O
InChIInChI=1S/C22H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21(24)23-20-17-19-22(25)26/h9-10H,2-8,11-20H2,1H3,(H,23,24)(H,25,26)/b10-9-
InChIKeyNFYDTZXYPVTQHJ-KTKRTIGZSA-N
ChEBI Ontology
Outgoing Relation(s)
N-Oleoyl GABA (CHEBI:165543) has functional parent γ-amino acid (CHEBI:33707)
N-Oleoyl GABA (CHEBI:165543) is a organonitrogen compound (CHEBI:35352)
N-Oleoyl GABA (CHEBI:165543) is a organooxygen compound (CHEBI:36963)
N-Oleoyl GABA (CHEBI:165543) is conjugate acid of N-oleoyl-γ-aminobutyrate (CHEBI:196969)
Incoming Relation(s)
N-oleoyl-γ-aminobutyrate (CHEBI:196969) is conjugate base of N-Oleoyl GABA (CHEBI:165543)
IUPAC Name 
4-[[(Z)-octadec-9-enoyl]amino]butanoic acid
Manual XrefsDatabases
52084787ChemSpider
HMDB0062335HMDB
LMFA08020104LIPID MAPS
Registry NumbersSources
CAS:133177-46-5ChemIDplus