EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:165780 - 14-HpODE

ChEBI IDCHEBI:165780
ChEBI Name14-HpODE
Stars
Last Modified23 February 2022
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O4
Net Charge0
Average Mass312.450
Monoisotopic Mass312.23006
SMILESCCCCC(/C=C/C/C=C/CCCCCCCC(=O)O)OO
InChIInChI=1S/C18H32O4/c1-2-3-14-17(22-21)15-12-10-8-6-4-5-7-9-11-13-16-18(19)20/h6,8,12,15,17,21H,2-5,7,9-11,13-14,16H2,1H3,(H,19,20)/b8-6+,15-12+
InChIKeyUNIRNFOYQCHZDZ-QWPOMPHKSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
14-HpODE (CHEBI:165780) is a HPODE (CHEBI:36329)
IUPAC Name 
(9E,12E)-14-hydroperoxyoctadeca-9,12-dienoic acid
Manual XrefsDatabases
4445987ChemSpider
LMFA02000104LIPID MAPS