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CHEBI:171868 - 11,12-Epoxyeicosatrienoic acid

ChEBI IDCHEBI:171868
ChEBI Name11,12-Epoxyeicosatrienoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32O3
Net Charge0
Average Mass320.473
Monoisotopic Mass320.23514
SMILESCCCCC/C=C/CC1OC1C/C=C/C/C=C/CCCC(=O)O
InChIInChI=1S/C20H32O3/c1-2-3-4-5-9-12-15-18-19(23-18)16-13-10-7-6-8-11-14-17-20(21)22/h6,8-10,12-13,18-19H,2-5,7,11,14-17H2,1H3,(H,21,22)/b8-6+,12-9+,13-10+
InChIKeyDXOYQVHGIODESM-ATELOPIESA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
11,12-Epoxyeicosatrienoic acid (CHEBI:171868) is a hepoxilin (CHEBI:36200)
IUPAC Name 
(5E,8E)-10-[3-[(E)-oct-2-enyl]oxiran-2-yl]deca-5,8-dienoic acid
Manual XrefsDatabases
4510033ChemSpider
C14770KEGG COMPOUND
HMDB0004673HMDB
LMFA03090011LIPID MAPS
Registry NumbersSources
CAS:81276-02-0ChemIDplus