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CHEBI:187053 - methyl-10-hydroperoxy-8E,12Z,15Z-octadecatrienoate

ChEBI IDCHEBI:187053
ChEBI Namemethyl-10-hydroperoxy-8E,12Z,15Z-octadecatrienoate
Stars
Last Modified24 January 2023
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H32O4
Net Charge0
Average Mass324.461
Monoisotopic Mass324.23006
SMILESCC/C=C\C/C=C\CC(/C=C/CCCCCCC(=O)OC)OO
InChIInChI=1S/C19H32O4/c1-3-4-5-6-9-12-15-18(23-21)16-13-10-7-8-11-14-17-19(20)22-2/h4-5,9,12-13,16,18,21H,3,6-8,10-11,14-15,17H2,1-2H3/b5-4-,12-9-,16-13+
InChIKeyJZABNNCYXIODDU-UNABKFHLSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
methyl-10-hydroperoxy-8E,12Z,15Z-octadecatrienoate (CHEBI:187053) is a fatty acid methyl ester (CHEBI:4986)
methyl-10-hydroperoxy-8E,12Z,15Z-octadecatrienoate (CHEBI:187053) is a hydroperoxy fatty ester (CHEBI:145037)
IUPAC Name 
methyl (8E,12Z,15Z)-10-hydroperoxyoctadeca-8,12,15-trienoate
Manual XrefsDatabases
LMFA01040038LIPID MAPS
4446000ChemSpider