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CHEBI:63970 - (5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid

ChEBI IDCHEBI:63970
ChEBI Name(5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid
Stars
ASCII Name(5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid
DefinitionA DHET obtained by formal dihydroxylation across the 8,9-double bond of arachidonic acid.
Secondary ChEBI IDCHEBI:34489
Last Modified3 October 2017
Submittermwilliams
DownloadsMolfile
FormulaC20H34O4
Net Charge0
Average Mass338.488
Monoisotopic Mass338.24571
SMILESCCCCC/C=C\C/C=C\CC(O)C(O)C/C=C\CCCC(=O)O
InChIInChI=1S/C20H34O4/c1-2-3-4-5-6-7-8-9-12-15-18(21)19(22)16-13-10-11-14-17-20(23)24/h6-7,9-10,12-13,18-19,21-22H,2-5,8,11,14-17H2,1H3,(H,23,24)/b7-6-,12-9-,13-10-
InChIKeyDCJBINATHQHPKO-TYAUOURKSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090)
- MetaboLights (MTBLS143)
- PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
(5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid (CHEBI:63970) has role mouse metabolite (CHEBI:75771)
(5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid (CHEBI:63970) is a DHET (CHEBI:64005)
(5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid (CHEBI:63970) is a diol (CHEBI:23824)
(5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid (CHEBI:63970) is a secondary allylic alcohol (CHEBI:134396)
(5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid (CHEBI:63970) is conjugate acid of (5Z,11Z,14Z)-8,9-dihydroxyicosatrienoate (CHEBI:84032)
Incoming Relation(s)
(5Z,8R,9R,11Z,14Z)-8,9-dihydroxyicosatrienoic acid (CHEBI:138586) is a (5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid (CHEBI:63970)
(5Z,8S,9S,11Z,14Z)-8,9-dihydroxyicosatrienoic acid (CHEBI:138585) is a (5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid (CHEBI:63970)
(5Z,11Z,14Z)-8,9-dihydroxyicosatrienoate (CHEBI:84032) is conjugate base of (5Z,11Z,14Z)-8,9-dihydroxyicosatrienoic acid (CHEBI:63970)
IUPAC Name 
(5Z,11Z,14Z)-8,9-dihydroxyicosa-5,11,14-trienoic acid
Synonyms  Source
8,9-DHETKEGG COMPOUND
(5Z,11Z,14Z)-8,9-Dihydroxyeicosa-5,11,14-trienoic acidKEGG COMPOUND
(5Z,11Z,14Z)-8,9-Dihydroxyicosa-5,11,14-trienoic acidKEGG COMPOUND
8,9-DiHETrESUBMITTER
8,9-dihydroxy-5Z,11Z,14Z-eicosatrienoic acidLIPID MAPS
8,9-DHETChEBI
Manual XrefsDatabases
C14773KEGG COMPOUND
LMFA03050006LIPID MAPS
HMDB0002311HMDB
Registry NumbersSources
Reaxys:9871378Reaxys
CAS:192461-96-4HMDB