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CHEBI:138005 - (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoate

ChEBI IDCHEBI:138005
ChEBI Name(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoate
Stars
ASCII Name(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoate
DefinitionA (5Z,8Z,14Z)-11,12-dihydroxyicosatrienoate obtained by deprotonation of the carboxy group of (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid; major species at pH 7.3.
Last Modified3 October 2017
Submitterlaimo
DownloadsMolfile
FormulaC20H33O4
Net Charge-1
Average Mass337.480
Monoisotopic Mass337.23843
SMILESCCCCC/C=C\C[C@H](O)[C@@H](O)C/C=C\C/C=C\CCCC(=O)[O-]
InChIInChI=1S/C20H34O4/c1-2-3-4-5-9-12-15-18(21)19(22)16-13-10-7-6-8-11-14-17-20(23)24/h6,8-10,12-13,18-19,21-22H,2-5,7,11,14-17H2,1H3,(H,23,24)/p-1/b8-6-,12-9-,13-10-/t18-,19-/m0/s1
InChIKeyLRPPQRCHCPFBPE-FLWFMKAKSA-M
ChEBI Ontology
Outgoing Relation(s)
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoate (CHEBI:138005) is a (5Z,8Z,14Z)-11,12-dihydroxyicosatrienoate (CHEBI:84031)
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoate (CHEBI:138005) is conjugate base of (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:138594)
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoate (CHEBI:138005) is enantiomer of (5Z,8Z,11R,12R,14Z)-11,12-dihydroxyicosatrienoate (CHEBI:138004)
Incoming Relation(s)
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:138594) is conjugate acid of (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoate (CHEBI:138005)
(5Z,8Z,11R,12R,14Z)-11,12-dihydroxyicosatrienoate (CHEBI:138004) is enantiomer of (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoate (CHEBI:138005)
IUPAC Name 
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosa-5,8,14-trienoate
Synonyms  Source
(11S,12S)-dihydroxy-(5Z,8Z,14Z)-icosatrienoateSUBMITTER
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyeicosatrienoateChEBI
(11S,12S)-DHET(1−)ChEBI
UniProt Name  Source
(11S,12S)-dihydroxy-(5Z,8Z,14Z)-eicosatrienoateUniProt
Citations