CHEBI:136485 - 8(S),15(S)-DiHETE

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ChEBI Name 8(S),15(S)-DiHETE
ChEBI ID CHEBI:136485
ChEBI ASCII Name 8(S),15(S)-DiHETE
Definition Ab 8,15-DiHETE that is derived from (5Z,9E,11Z,13E)-icosatetraenoic acid and has (8S,15S)-stereochemistry.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H32O4
Net Charge 0
Average Mass 336.466
Monoisotopic Mass 336.23006
InChI InChI=1S/C20H32O4/c1-2-3-8-13-18(21)14-9-4-5-10-15-19(22)16-11-6-7-12-17-20(23)24/h4-6,9-11,14-15,18-19,21-22H,2-3,7-8,12-13,16-17H2,1H3,(H,23,24)/b5-4-,11-6-,14-9+,15-10+/t18-,19+/m0/s1
InChIKey NNPWRKSGORGTIM-HCCKYKKOSA-N
SMILES C(=C\C=C\[C@H](CCCCC)O)\C=C\[C@H](C/C=C\CCCC(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): 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).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 8(S),15(S)-DiHETE (CHEBI:136485) has functional parent arachidonic acid (CHEBI:15843)
8(S),15(S)-DiHETE (CHEBI:136485) has role human xenobiotic metabolite (CHEBI:76967)
8(S),15(S)-DiHETE (CHEBI:136485) has role mouse metabolite (CHEBI:75771)
8(S),15(S)-DiHETE (CHEBI:136485) is a 8,15-DiHETE (CHEBI:88456)
8(S),15(S)-DiHETE (CHEBI:136485) is conjugate acid of 8(S),15(S)-DiHETE(1−) (CHEBI:133903)
Incoming 8(S),15(S)-DiHETE(1−) (CHEBI:133903) is conjugate base of 8(S),15(S)-DiHETE (CHEBI:136485)
IUPAC Name
(5Z,8S,9E,11Z,13E,15S)-8,15-dihydroxyicosa-5,9,11,13-tetraenoic acid
Synonyms Sources
(5Z,8S,9E,11Z,13E,15S)-8,15-dihydroxyeicosatetraenoic acid ChEBI
(5Z,8S,9E,11Z,13E,15S)-8,15-dihydroxyicosatetraenoic acid ChEBI
(8S,15S)-DiHETE ChEBI
(8S,15S)-dihydroxy-(5Z,9E,11Z,13E)-eicosatetraenoic acid ChEBI
(8S,15S)-dihydroxy-(5Z,9E,11Z,13E)-icosatetraenoic acid ChEBI
8S,15S-DiHETE LIPID MAPS
8S,15S-dihydroxy-5Z,9E,11Z,13E-eicosatetraenoic acid LIPID MAPS
Manual Xref Database
LMFA03060050 LIPID MAPS
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Registry Number Type Source
4699128 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
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Last Modified
08 March 2017