EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:184268 - 5-Oxo-ETE-d7

ChEBI IDCHEBI:184268
ChEBI Name5-Oxo-ETE-d7
Stars
Last Modified25 January 2023
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H23D7O3
Net Charge0
Average Mass325.500
Monoisotopic Mass325.26343
SMILES[2H]C(/C=C(\[2H])C(=O)CCCC(=O)O)=C(\[2H])C/C([2H])=C(/[2H])C/C([2H])=C(/[2H])CCCCC
InChIInChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h6-7,9-10,12-14,16H,2-5,8,11,15,17-18H2,1H3,(H,22,23)/b7-6-,10-9-,13-12-,16-14+/i6D,7D,9D,10D,12D,13D,16D
InChIKeyMEASLHGILYBXFO-BWRCDNCFSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) serum (BTO:0001239) MetaboLights (MTBLS3725)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
5-Oxo-ETE-d7 (CHEBI:184268) is a deuterated fatty acid (CHEBI:75427)
5-Oxo-ETE-d7 (CHEBI:184268) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(6E,8Z,11Z,14Z)-6,8,9,11,12,14,15-heptadeuterio-5-oxoicosa-6,8,11,14-tetraenoic acid
Manual XrefsDatabases
17220807ChemSpider
LMFA03060083LIPID MAPS