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CHEBI:231069 - 18-Hydroperoxyoctadeca-2,4-dienoic acid

ChEBI IDCHEBI:231069
ChEBI Name18-Hydroperoxyoctadeca-2,4-dienoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O4
Net Charge0
Average Mass312.450
Monoisotopic Mass312.23006
SMILESO=C(O)/C=C/C=C/CCCCCCCCCCCCCOO
InChIInChI=1S/C18H32O4/c19-18(20)16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-22-21/h10,12,14,16,21H,1-9,11,13,15,17H2,(H,19,20)/b12-10+,16-14+
InChIKeyACUNLGKYUQGPDZ-PQSJUVMFSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
18-Hydroperoxyoctadeca-2,4-dienoic acid (CHEBI:231069) is a lipid (CHEBI:18059)
IUPAC Name 
(2E,4E)-18-hydroperoxyoctadeca-2,4-dienoic acid