CHEBI:137193 - (5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoic acid

ChEBI IDCHEBI:137193
ChEBI Name(5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoic acid
Stars
ASCII Name(5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoic acid
DefinitionAn EpETE obtained by formal epoxidation of the 8,9-double bond of all-cis-5,8,11,14,17-icosapentaenoic acid.
Last Modified30 May 2017
SubmitterSteve
DownloadsMolfile
FormulaC20H30O3
Net Charge0
Average Mass318.457
Monoisotopic Mass318.21949
SMILESCC/C=C\C/C=C\C/C=C\CC1OC1C/C=C\CCCC(=O)O
InChIInChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-12-15-18-19(23-18)16-13-10-11-14-17-20(21)22/h3-4,6-7,9-10,12-13,18-19H,2,5,8,11,14-17H2,1H3,(H,21,22)/b4-3-,7-6-,12-9-,13-10-
InChIKeyYKIOHMXLFWMWKD-JJUYGIQRSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
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)
(5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoic acid (CHEBI:137193) has functional parent all-cis-5,8,11,14,17-icosapentaenoic acid (CHEBI:28364)
(5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoic acid (CHEBI:137193) is a EpETE (CHEBI:72852)
(5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoic acid (CHEBI:137193) is conjugate acid of (5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoate (CHEBI:136439)
Incoming Relation(s)
(5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoate (CHEBI:136439) is conjugate base of (5Z,11Z,14Z,17Z)-8,9-epoxyicosatetraenoic acid (CHEBI:137193)
IUPAC Name 
(5Z)-7-{3-[(2Z,5Z,8Z)-undeca-2,5,8-trien-1-yl]oxiran-2-yl}hept-5-enoic acid
Synonyms  Source
8,9-epoxy-(5Z,11Z,14Z,17Z)-icosatetraenoic acidChEBI
8(9)-EpETEChEBI
8,9-epoxy-(5Z,11Z,14Z,17Z)-eicosatetraenoic acidChEBI
8(9)-epoxy-5Z,11Z,14Z,17Z-eicosatetraenoic acidLIPID MAPS
(5Z,11Z,14Z)-8,9-Epoxyicosa-5,11,14-trienoic acidHMDB
8,9-Epoxyicosatrienoic acidHMDB
Manual XrefsDatabases
LMFA03000001LIPID MAPS
HMDB0002232HMDB
Registry NumbersSources
Reaxys:14580554Reaxys
Citations