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CHEBI:50097 - 13-hydroperoxylinoleic acid

ChEBI IDCHEBI:50097
ChEBI Name13-hydroperoxylinoleic acid
Stars
Last Modified24 January 2023
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC18H32O4
Net Charge0
Average Mass312.450
Monoisotopic Mass312.23006
SMILESCCCCCC(=CC/C=C\CCCCCCCC(=O)O)OO
InChIInChI=1S/C18H32O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h7,9,15,21H,2-6,8,10-14,16H2,1H3,(H,19,20)/b9-7-,17-15?
InChIKeyITZHGZMZQUJODL-MMDKRFMXSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
13-hydroperoxylinoleic acid (CHEBI:50097) has functional parent linoleic acid (CHEBI:17351)
13-hydroperoxylinoleic acid (CHEBI:50097) is a hydroperoxy polyunsaturated fatty acid (CHEBI:189832)
IUPAC Name 
(9Z)-13-hydroperoxyoctadeca-9,12-dienoic acid
Synonym  Source
13-HplaChemIDplus
Registry NumbersSources
Beilstein:2278630Beilstein
CAS:34444-18-3ChemIDplus