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CHEBI:72866 - 8-HETrE

ChEBI IDCHEBI:72866
ChEBI Name8-HETrE
Stars
DefinitionA hydroxyeicosatrienoic acid that consists of 9E,11Z,14Z-eicosatrienoic acid bearing an 8-hydroxy substituent.
Last Modified23 March 2018
Submittermwilliams
DownloadsMolfile
FormulaC20H34O3
Net Charge0
Average Mass322.489
Monoisotopic Mass322.25079
SMILESCCCCC/C=C\C/C=C\C=C\C(O)CCCCCCC(=O)O
InChIInChI=1S/C20H34O3/c1-2-3-4-5-6-7-8-9-10-13-16-19(21)17-14-11-12-15-18-20(22)23/h6-7,9-10,13,16,19,21H,2-5,8,11-12,14-15,17-18H2,1H3,(H,22,23)/b7-6-,10-9-,16-13+
InChIKeySKIQVURLERJJCK-SFULQBOPSA-N
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:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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)
8-HETrE (CHEBI:72866) has functional parent all-cis-icosa-8,11,14-trienoic acid (CHEBI:53486)
8-HETrE (CHEBI:72866) has role metabolite (CHEBI:25212)
8-HETrE (CHEBI:72866) is a HETrE (CHEBI:72793)
Incoming Relation(s)
8(S)-HETrE (CHEBI:140473) is a 8-HETrE (CHEBI:72866)
IUPAC Name 
(9E,11Z,14Z)-8-hydroxyicosa-9,11,14-trienoic acid
Synonyms  Source
8-hydroxy-9E,11Z,14Z-eicosatrienoic acidIUPAC
(9E,11Z,14Z)-8-hydroxyeicosa-9,11,14-trienoic acidChEBI
8-hydroxy-9E,11Z,14Z-icosatrienoic acidChEBI