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CHEBI:145300 - (9Z,11E,15Z)-13-hydroperoxyoctadecatrienoic acid

ChEBI IDCHEBI:145300
ChEBI Name(9Z,11E,15Z)-13-hydroperoxyoctadecatrienoic acid
Stars
ASCII Name(9Z,11E,15Z)-13-hydroperoxyoctadecatrienoic acid
DefinitionA hydroperoxyoctadecatrienoic acid that is (9Z,11E,15Z)-octadecatrienoic acid which is substituted at position 13 by a hydroperoxy group.
Last Modified5 November 2019
SubmitterGareth Owen
DownloadsMolfile
FormulaC18H30O4
Net Charge0
Average Mass310.434
Monoisotopic Mass310.21441
SMILESCC/C=C\CC(/C=C/C=C\CCCCCCCC(=O)O)OO
InChIInChI=1S/C18H30O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h3,7,9,11-12,15,17,21H,2,4-6,8,10,13-14,16H2,1H3,(H,19,20)/b9-7-,11-3-,15-12+
InChIKeyUYQGVDXDXBAABN-JDTPQGGVSA-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)
(9Z,11E,15Z)-13-hydroperoxyoctadecatrienoic acid (CHEBI:145300) is a hydroperoxyoctadecatrienoic acid (CHEBI:134615)
(9Z,11E,15Z)-13-hydroperoxyoctadecatrienoic acid (CHEBI:145300) is conjugate acid of (9Z,11E,15Z)-13-hydroperoxyoctadecatrienoate (CHEBI:144034)
Incoming Relation(s)
(9Z,11E,15Z)-13-hydroperoxyoctadecatrienoate (CHEBI:144034) is conjugate base of (9Z,11E,15Z)-13-hydroperoxyoctadecatrienoic acid (CHEBI:145300)
IUPAC Name 
(9Z,11E,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoic acid
Synonym  Source
13-HpOTrELIPID MAPS
Manual XrefsDatabases
LMFA02000110LIPID MAPS
Citations