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CHEBI:184045 - Docosahexaenoylglycine

ChEBI IDCHEBI:184045
ChEBI NameDocosahexaenoylglycine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H35NO3
Net Charge0
Average Mass385.548
Monoisotopic Mass385.26169
SMILESCCCCCCCCCC=CC=CC=CC=CC=CC=CC(=O)NCC(=O)O
InChIInChI=1S/C24H35NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(26)25-22-24(27)28/h10-21H,2-9,22H2,1H3,(H,25,26)(H,27,28)
InChIKeyKXBXJDAVBNHVKW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nippostrongylus brasiliensis (ncbitaxon:27835) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3486)
Mus musculus (ncbitaxon:10090) small intestine (BTO:0000651) MetaboLights (MTBLS3486) Strain: C57BL/6 Mouse [THESAURUS.OWL#C14424]
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Docosahexaenoylglycine (CHEBI:184045) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
2-(docosa-2,4,6,8,10,12-hexaenoylamino)acetic acid
Manual XrefsDatabases
26542107ChemSpider