CHEBI:72866 - 8-HETrE

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 8-HETrE
ChEBI ID CHEBI:72866
Definition A hydroxyeicosatrienoic acid that consists of 9E,11Z,14Z-eicosatrienoic acid bearing an 8-hydroxy substituent.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H34O3
Net Charge 0
Average Mass 322.48220
Monoisotopic Mass 322.25079
InChI InChI=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+
InChIKey SKIQVURLERJJCK-SFULQBOPSA-N
SMILES CCCCC\C=C/C\C=C/C=C/C(O)CCCCCCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via HETrE )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 8(S)-HETrE (CHEBI:140473) is a 8-HETrE (CHEBI:72866)
IUPAC Name
(9E,11Z,14Z)-8-hydroxyicosa-9,11,14-trienoic acid
Synonyms Sources
(9E,11Z,14Z)-8-hydroxyeicosa-9,11,14-trienoic acid ChEBI
8-hydroxy-9E,11Z,14Z-eicosatrienoic acid IUPAC
8-hydroxy-9E,11Z,14Z-icosatrienoic acid ChEBI
Last Modified
23 March 2018