CHEBI:138594 - (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid
ChEBI ID CHEBI:138594
ChEBI ASCII Name (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid
Definition A (5Z,8Z,14Z)-11,12-dihydroxyicosatrienoic acid in which the two stereocentres at positions 11 and 12 both have S-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C20H34O4
Net Charge 0
Average Mass 338.482
Monoisotopic Mass 338.24571
InChI InChI=1S/C20H34O4/c1-2-3-4-5-9-12-15-18(21)19(22)16-13-10-7-6-8-11-14-17-20(23)24/h6,8-10,12-13,18-19,21-22H,2-5,7,11,14-17H2,1H3,(H,23,24)/b8-6-,12-9-,13-10-/t18-,19-/m0/s1
InChIKey LRPPQRCHCPFBPE-FLWFMKAKSA-N
SMILES C(CCC)C/C=C\C[C@@H]([C@H](C/C=C\C/C=C\CCCC(O)=O)O)O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via (5Z,8Z,14Z)-11,12-dihydroxyicosatrienoic acid )
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via DHET )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:138594) has functional parent arachidonic acid (CHEBI:15843)
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:138594) is a (5Z,8Z,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:63969)
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:138594) is conjugate acid of (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoate (CHEBI:138005)
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:138594) is enantiomer of (5Z,8Z,11R,12R,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:138593)
Incoming (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoate (CHEBI:138005) is conjugate base of (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:138594)
(5Z,8Z,11R,12R,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:138593) is enantiomer of (5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosatrienoic acid (CHEBI:138594)
IUPAC Name
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyicosa-5,8,14-trienoic acid
Synonyms Sources
(11S,12S)-DHET ChEBI
(11S,12S)-dihydroxy-(5Z,8Z,14Z)-eicosatrienoic acid ChEBI
(11S,12S)-dihydroxy-(5Z,8Z,14Z)-icosatrienoic acid ChEBI
(5Z,8Z,11S,12S,14Z)-11,12-dihydroxyeicosatrienoic acid ChEBI
Registry Number Type Source
6958355 Reaxys Registry Number Reaxys
Last Modified
03 October 2017