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CHEBI:165582 - 8,9-DiHETrE-EA

ChEBI IDCHEBI:165582
ChEBI Name8,9-DiHETrE-EA
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H39NO4
Net Charge0
Average Mass381.557
Monoisotopic Mass381.28791
SMILESCCCCC/C=C\C/C=C\CC(O)C(O)C/C=C\CCCC(=O)NCCO
InChIInChI=1S/C22H39NO4/c1-2-3-4-5-6-7-8-9-12-15-20(25)21(26)16-13-10-11-14-17-22(27)23-18-19-24/h6-7,9-10,12-13,20-21,24-26H,2-5,8,11,14-19H2,1H3,(H,23,27)/b7-6-,12-9-,13-10-
InChIKeyVBCWCYKNZSTKQW-TYAUOURKSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
8,9-DiHETrE-EA (CHEBI:165582) is a N-acylethanolamine (CHEBI:52640)
IUPAC Name 
(5Z,11Z,14Z)-8,9-dihydroxy-N-(2-hydroxyethyl)icosa-5,11,14-trienamide
Manual XrefsDatabases
LMFA08040030LIPID MAPS
17220858ChemSpider