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CHEBI:72786 - 9-HETE

ChEBI IDCHEBI:72786
ChEBI Name9-HETE
Stars
DefinitionAn HETE that is (5Z,7E,11Z,14Z)-icosa-5,7,11,14-tetraenoic acid in which the hydroxy group is located at position 9.
Last Modified1 March 2017
Submittermwilliams
DownloadsMolfile
FormulaC20H32O3
Net Charge0
Average Mass320.473
Monoisotopic Mass320.23514
SMILESCCCCC/C=C\C/C=C\CC(O)/C=C/C=C\CCCC(=O)O
InChIInChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-10-13-16-19(21)17-14-11-9-12-15-18-20(22)23/h6-7,9-11,13-14,17,19,21H,2-5,8,12,15-16,18H2,1H3,(H,22,23)/b7-6-,11-9-,13-10-,17-14+
InChIKeyKATOYYZUTNAWSA-OIZRIKEUSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
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)
9-HETE (CHEBI:72786) has role metabolite (CHEBI:25212)
9-HETE (CHEBI:72786) is a HETE (CHEBI:36275)
9-HETE (CHEBI:72786) is conjugate acid of 9-HETE(1−) (CHEBI:133850)
Incoming Relation(s)
9-HETE(1−) (CHEBI:133850) is conjugate base of 9-HETE (CHEBI:72786)
IUPAC Name 
(5Z,7E,11Z,14Z)-9-hydroxyicosa-5,7,11,14-tetraenoic acid
Synonyms  Source
9-hydroxy-5Z,7E,11Z,14Z-eicosatetraenoic acidLIPID MAPS
9-hydroxy-(5Z,7E,11Z,14Z)-icosatetraenoic acidChEBI
Manual XrefsDatabases
LMFA03060089LIPID MAPS
Registry NumbersSources
Reaxys:4476711Reaxys