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CHEBI:133987 - (9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoate

ChEBI IDCHEBI:133987
ChEBI Name(9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoate
Stars
ASCII Name(9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoate
DefinitionA hydroperoxyoctadecatrienoate that is the conjugate base of (9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoic acid, obtained by deprotonation of the carboxy group. Major microspecies at pH 7.3.
Last Modified20 March 2017
SubmitterAnne Morgat
DownloadsMolfile
FormulaC18H29O4
Net Charge-1
Average Mass309.426
Monoisotopic Mass309.20713
SMILESCC/C=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/h3,7,9,11-12,15,17,21H,2,4-6,8,10,13-14,16H2,1H3,(H,19,20)/p-1/b9-7-,11-3-,15-12+/t17-/m1/s1
InChIKeyUYQGVDXDXBAABN-YVCRHRKHSA-M
ChEBI Ontology
Outgoing Relation(s)
(9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoate (CHEBI:133987) is a hydroperoxyoctadecatrienoate (CHEBI:133558)
(9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoate (CHEBI:133987) is conjugate base of (9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoic acid (CHEBI:133986)
Incoming Relation(s)
(9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoic acid (CHEBI:133986) is conjugate acid of (9Z,11E,13R,15Z)-13-hydroperoxyoctadecatrienoate (CHEBI:133987)
IUPAC Name 
(9Z,11E,13R,15Z)-13-hydroperoxyoctadeca-9,11,15-trienoate
Synonyms  Source
13(R)-HPOTrE(1−)ChEBI
(13R)-hydroperoxy-(9Z,11E,15Z)-octadeca-9,11,15-trienoateChEBI
(13R)-HPOTrE(1−)ChEBI
UniProt Name  Source
(13R)-hydroperoxy-(9Z,11E,15Z)-octadecatrienoateUniProt