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CHEBI:36435 - (9Z,11E,13S,14Z)-13-hydroperoxyoctadeca-9,11,14-trienoate

ChEBI IDCHEBI:36435
ChEBI Name(9Z,11E,13S,14Z)-13-hydroperoxyoctadeca-9,11,14-trienoate
Stars
ASCII Name(9Z,11E,13S,14Z)-13-hydroperoxyoctadeca-9,11,14-trienoate
DefinitionThe conjugate base of (9Z,11E,13S,14Z)-13-hydroperoxyoctadeca-9,11,14-trienic acid.
Secondary ChEBI IDsCHEBI:10942, CHEBI:18621
Last Modified11 April 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC18H29O4
Net Charge-1
Average Mass309.426
Monoisotopic Mass309.20713
SMILESCCC/C=C\[C@@H](/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/h7,9,11-12,14-15,17,21H,2-6,8,10,13,16H2,1H3,(H,19,20)/p-1/b9-7-,14-11-,15-12+/t17-/m0/s1
InChIKeyUKAYSZOBJMGOTG-NVZNDERGSA-M
ChEBI Ontology
Outgoing Relation(s)
(9Z,11E,13S,14Z)-13-hydroperoxyoctadeca-9,11,14-trienoate (CHEBI:36435) has functional parent (9Z,11E,14Z)-octadeca-9,11,14-trienoate (CHEBI:38392)
(9Z,11E,13S,14Z)-13-hydroperoxyoctadeca-9,11,14-trienoate (CHEBI:36435) is a monocarboxylic acid anion (CHEBI:35757)
(9Z,11E,13S,14Z)-13-hydroperoxyoctadeca-9,11,14-trienoate (CHEBI:36435) is conjugate base of (9Z,11E,13S,14Z)-13-hydroperoxyoctadecatrienoic acid (CHEBI:136803)
Incoming Relation(s)
(9Z,11E,13S,14Z)-13-hydroperoxyoctadecatrienoic acid (CHEBI:136803) is conjugate acid of (9Z,11E,13S,14Z)-13-hydroperoxyoctadeca-9,11,14-trienoate (CHEBI:36435)
IUPAC Name 
(9Z,11E,13S,14Z)-13-hydroperoxyoctadeca-9,11,14-trienoate
Synonym  Source
(9Z,11E,14Z)-(13S)-Hydroperoxyoctadeca-(9,11,14)-trienoateKEGG COMPOUND