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CHEBI:132683 - (5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid

ChEBI IDCHEBI:132683
ChEBI Name(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid
Stars
ASCII Name(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid
DefinitionA hydroperoxy fatty acid that is (14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid in which the hydroperoxy group is located at position 5S.
Last Modified21 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC20H32O5
Net Charge0
Average Mass352.471
Monoisotopic Mass352.22497
SMILESCCCCC[C@@H]1O[C@@H]1C/C=C\C/C=C\C=C\[C@H](CCCC(=O)O)OO
InChIInChI=1S/C20H32O5/c1-2-3-8-14-18-19(24-18)15-10-7-5-4-6-9-12-17(25-23)13-11-16-20(21)22/h4,6-7,9-10,12,17-19,23H,2-3,5,8,11,13-16H2,1H3,(H,21,22)/b6-4-,10-7-,12-9+/t17-,18+,19-/m1/s1
InChIKeyKTJVOVFOUDDZLQ-UDZUBBEJSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (25293588)
Mus musculus (ncbitaxon:10090) - PubMed (25293588)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid (CHEBI:132683) has role human xenobiotic metabolite (CHEBI:76967)
(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid (CHEBI:132683) has role mouse metabolite (CHEBI:75771)
(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid (CHEBI:132683) is a hydroperoxy(epoxy)icosatrienoic acid (CHEBI:134641)
(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid (CHEBI:132683) is conjugate acid of (5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoate (CHEBI:132067)
Incoming Relation(s)
(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoate (CHEBI:132067) is conjugate base of (5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-icosatrienoic acid (CHEBI:132683)
IUPAC Name 
(5S,6E,8Z,11Z)-5-hydroperoxy-13-[(2R,3S)-3-pentyloxiran-2-yl]trideca-6,8,11-trienoic acid
Synonyms  Source
(5S)-hydroperoxy-(14R,15S)-EETChEBI
(5S)-hydroperoxy-(14R,15S)-epoxy-(6E,8Z,11Z)-eicosatrienoic acidChEBI
(5S)-HP-(14R,15S)-EETChEBI
Citations