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CHEBI:76955 - 17(S),18(R)-EETeTr

ChEBI IDCHEBI:76955
ChEBI Name17(S),18(R)-EETeTr
Stars
ASCII Name17(S),18(R)-EETeTr
DefinitionA 17(18)-EpETE in which the epoxy group has (17S,18R)-configuration.
Last Modified13 January 2014
SubmitterSteve
DownloadsMolfile
FormulaC20H30O3
Net Charge0
Average Mass318.457
Monoisotopic Mass318.21949
SMILESCC[C@H]1O[C@H]1C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O
InChIInChI=1S/C20H30O3/c1-2-18-19(23-18)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-20(21)22/h3,5-6,8-9,11-12,14,18-19H,2,4,7,10,13,15-17H2,1H3,(H,21,22)/b5-3-,8-6-,11-9-,14-12-/t18-,19+/m1/s1
InChIKeyGPQVVJQEBXAKBJ-YQLHGUCYSA-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).
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 Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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)
17(S),18(R)-EETeTr (CHEBI:76955) is a 17(18)-EpETE (CHEBI:72853)
17(S),18(R)-EETeTr (CHEBI:76955) is conjugate acid of 17(S),18(R)-EETeTr(1−) (CHEBI:76635)
17(S),18(R)-EETeTr (CHEBI:76955) is enantiomer of 17(R),18(S)-EETeTr (CHEBI:76953)
Incoming Relation(s)
17(S),18(R)-EETeTr(1−) (CHEBI:76635) is conjugate base of 17(S),18(R)-EETeTr (CHEBI:76955)
17(R),18(S)-EETeTr (CHEBI:76953) is enantiomer of 17(S),18(R)-EETeTr (CHEBI:76955)
IUPAC Name 
(5Z,8Z,11Z,14Z)-16-[(2S,3R)-3-ethyloxiran-2-yl]hexadeca-5,8,11,14-tetraenoic acid
Synonyms  Source
(17S,18R)-epoxy-(5Z,8Z,11Z,14Z)-eicosatetraenoic acidChEBI
(17S,18R)-epoxy-(5Z,8Z,11Z,14Z)-icosatetraenoic acidChEBI
(5Z,8Z,11Z,14Z,17S,18R)-17,18-epoxyicosatetraenoic acidChEBI
(5Z,8Z,11Z,14Z,17S,18R)-17,18-epoxyeicosatetraenoic acidChEBI
Registry NumbersSources
Reaxys:21591682Reaxys