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CHEBI:90866 - 14-HDoHE(1−)

ChEBI IDCHEBI:90866
ChEBI Name14-HDoHE(1−)
Stars
ASCII Name14-HDoHE(1-)
DefinitionA polyunsaturated hydroxy-fatty acid anion that is the conjugate base of 14-HDoHE, arising from deprotonation of the carboxylic acid function; major species at pH 7.3.
Last Modified23 February 2016
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC22H31O3
Net Charge-1
Average Mass343.487
Monoisotopic Mass343.22787
SMILESCC/C=C\C/C=C\CC(O)/C=C/C=C\C/C=C\C/C=C\CCC(=O)[O-]
InChIInChI=1S/C22H32O3/c1-2-3-4-5-12-15-18-21(23)19-16-13-10-8-6-7-9-11-14-17-20-22(24)25/h3-4,6-7,10-16,19,21,23H,2,5,8-9,17-18,20H2,1H3,(H,24,25)/p-1/b4-3-,7-6-,13-10-,14-11-,15-12-,19-16+
InChIKeyZNEBXONKCYFJAF-BGKMTWLOSA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (25586183)
Roles Classification
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
14-HDoHE(1−) (CHEBI:90866) has role human xenobiotic metabolite (CHEBI:76967)
14-HDoHE(1−) (CHEBI:90866) is a hydroxy fatty acid anion (CHEBI:59835)
14-HDoHE(1−) (CHEBI:90866) is a hydroxydocosahexaenoate (CHEBI:131867)
14-HDoHE(1−) (CHEBI:90866) is a long-chain fatty acid anion (CHEBI:57560)
14-HDoHE(1−) (CHEBI:90866) is a polyunsaturated fatty acid anion (CHEBI:76567)
14-HDoHE(1−) (CHEBI:90866) is conjugate base of 14-HDoHE (CHEBI:72647)
Incoming Relation(s)
(14R)-HDoHE(1−) (CHEBI:136525) is a 14-HDoHE(1−) (CHEBI:90866)
(14S)-HDoHE(1−) (CHEBI:136526) is a 14-HDoHE(1−) (CHEBI:90866)
14-HDoHE (CHEBI:72647) is conjugate acid of 14-HDoHE(1−) (CHEBI:90866)
IUPAC Name 
(4Z,7Z,10Z,12E,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoate
Synonym  Source
(4Z,7Z,10Z,12E,16Z,19Z)-14-hydroxydocosahexaenoateChEBI
UniProt Name  Source
14-hydroxy-(4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoateUniProt
Citations