CHEBI:88347 - 15(S)-HEPE

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 15(S)-HEPE
ChEBI ID CHEBI:88347
ChEBI ASCII Name 15(S)-HEPE
Definition A 15-HEPE that consists of (5Z,8Z,11Z,13E,17Z)-icosapentaenoic acid in which the 15-hydroxy group has S-configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information eMolecules:1934501
Download Molfile XML SDF
more structures >>
Formula C20H30O3
Net Charge 0
Average Mass 318.451
Monoisotopic Mass 318.21949
InChI InChI=1S/C20H30O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h3-5,8-11,13-14,17,19,21H,2,6-7,12,15-16,18H2,1H3,(H,22,23)/b5-4-,10-8-,11-9-,13-3-,17-14+/t19-/m0/s1
InChIKey WLKCSMCLEKGITB-DBVSHIMFSA-N
SMILES C(\CC)=C\C[C@@H](/C=C/C=C\C/C=C\C/C=C\CCCC(=O)O)O
Metabolite of Species Details
Drosophila melanogaster (NCBI:txid7227) See: PubMed
Homo sapiens (NCBI:txid9606) See: MetaboLights Study
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).
(via 15-HEPE )
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via HEPE )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 15(S)-HEPE (CHEBI:88347) has role human xenobiotic metabolite (CHEBI:76967)
15(S)-HEPE (CHEBI:88347) is a 15-HEPE (CHEBI:72627)
15(S)-HEPE (CHEBI:88347) is conjugate acid of 15(S)-HEPE(1−) (CHEBI:132087)
15(S)-HEPE (CHEBI:88347) is enantiomer of 15(R)-HEPE (CHEBI:91140)
Incoming 15(S)-HEPE(1−) (CHEBI:132087) is conjugate base of 15(S)-HEPE (CHEBI:88347)
15(R)-HEPE (CHEBI:91140) is enantiomer of 15(S)-HEPE (CHEBI:88347)
IUPAC Name
(5Z,8Z,11Z,13E,15S,17Z)-15-hydroxyicosa-5,8,11,13,17-pentaenoic acid
Synonyms Sources
(5Z,8Z,11Z,13E,15S,17Z)-15-hydroxyicosapentaenoic acid ChEBI
15S-HEPE LIPID MAPS
15S-hydroxy-5Z,8Z,11Z,13E,17Z-eicosapentaenoic acid LIPID MAPS
Manual Xref Database
LMFA03070009 LIPID MAPS
View more database links
Registry Number Type Source
26880603 Reaxys Registry Number Reaxys
Citations Types Sources
15850718 PubMed citation Europe PMC
19538551 PubMed citation Europe PMC
21206090 PubMed citation Europe PMC
26931457 PubMed citation Europe PMC
Last Modified
22 July 2016