CHEBI:91286 - 5(S),15(S)-DiHETE

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5(S),15(S)-DiHETE
ChEBI ID CHEBI:91286
ChEBI ASCII Name 5(S),15(S)-DiHETE
Definition A DiHETE that is (6E,8Z,11Z,13E)-icosatetraenoic acid in which the two hydroxy substituents are placed at the 5S- and 15S-positions.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C20H32O4
Net Charge 0
Average Mass 336.466
Monoisotopic Mass 336.23006
InChI InChI=1S/C20H32O4/c1-2-3-9-13-18(21)14-10-7-5-4-6-8-11-15-19(22)16-12-17-20(23)24/h5-8,10-11,14-15,18-19,21-22H,2-4,9,12-13,16-17H2,1H3,(H,23,24)/b7-5-,8-6-,14-10+,15-11+/t18-,19+/m0/s1
InChIKey UXGXCGPWGSUMNI-BVHTXILBSA-N
SMILES C(CCC[C@@H](/C=C/C=C\C/C=C\C=C\[C@H](CCCCC)O)O)(O)=O
Metabolite of Species Details
Rattus norvegicus (NCBI:txid10116) See: PubMed
Homo sapiens (NCBI:txid9606) See: PubMed
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): rat metabolite
Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 5(S),15(S)-DiHETE (CHEBI:91286) has role human xenobiotic metabolite (CHEBI:76967)
5(S),15(S)-DiHETE (CHEBI:91286) has role rat metabolite (CHEBI:86264)
5(S),15(S)-DiHETE (CHEBI:91286) is a dihydroxyicosatetraenoic acid (CHEBI:72868)
5(S),15(S)-DiHETE (CHEBI:91286) is conjugate acid of 5(S),15(S)-DiHETE(1−) (CHEBI:90813)
Incoming 5(S),15(S)-DiHETE(1−) (CHEBI:90813) is conjugate base of 5(S),15(S)-DiHETE (CHEBI:91286)
IUPAC Name
(5S,6E,8Z,11Z,13E,15S)-5,15-dihydroxyicosa-6,8,11,13-tetraenoic acid
Synonyms Sources
(5S,15S)-dihydroxy-(6E,8Z,11Z,13E)-eicosatetraenoic acid ChEBI
(5S,15S)-dihydroxy-(6E,8Z,11Z,13E)-icosatetraenoic acid ChEBI
(5S,6E,8Z,11Z,13E,15S)-5,15-dihydroxyicosatetraenoic acid ChEBI
5(S),15(S)-Dihydroxy-6,13-trans-8,11-cis-eicosatetraenoic acid ChemIDplus
5,15-DiHETE HMDB
5,15-Dihydroxy-6,8,11,13-eicosatetraenoic acid HMDB
5,15-Dihydroxyeicosatetraenoic acid HMDB
5S,15S-DiHETE LIPID MAPS
5S,15S-dihydroxy-6E,8Z,11Z,13E-eicosatetraenoic acid LIPID MAPS
Manual Xrefs Databases
HMDB0010216 HMDB
LMFA03060010 LIPID MAPS
View more database links
Registry Numbers Types Sources
4472597 Reaxys Registry Number Reaxys
82200-87-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
2127820 PubMed citation Europe PMC
2155268 PubMed citation Europe PMC
22068350 PubMed citation Europe PMC
26398714 PubMed citation Europe PMC
6806263 PubMed citation Europe PMC
Last Modified
22 February 2016