EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:81563 - 18(R)-HEPE

ChEBI IDCHEBI:81563
ChEBI Name18(R)-HEPE
Stars
ASCII Name18(R)-HEPE
DefinitionAn 18-HEPE that consists of (5Z,8Z,11Z,14Z,16E)-icosapentaenoic in which the 18-hydroxy group has R-configuration.
Last Modified22 July 2016
DownloadsMolfile
FormulaC20H30O3
Net Charge0
Average Mass318.457
Monoisotopic Mass318.21949
SMILESCC[C@@H](O)/C=C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O
InChIInChI=1S/C20H30O3/c1-2-19(21)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20(22)23/h4-7,10-13,15,17,19,21H,2-3,8-9,14,16,18H2,1H3,(H,22,23)/b6-4-,7-5-,12-10-,13-11-,17-15+/t19-/m1/s1
InChIKeyLRWYBGFSVUBWMO-UAAZXLHOSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (11034610)
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application:
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
ChEBI Ontology
Outgoing Relation(s)
18(R)-HEPE (CHEBI:81563) has role anti-inflammatory agent (CHEBI:67079)
18(R)-HEPE (CHEBI:81563) has role mouse metabolite (CHEBI:75771)
18(R)-HEPE (CHEBI:81563) is a 18-HEPE (CHEBI:72802)
18(R)-HEPE (CHEBI:81563) is conjugate acid of 18(R)-HEPE(1−) (CHEBI:90818)
18(R)-HEPE (CHEBI:81563) is enantiomer of 18(S)-HEPE (CHEBI:132801)
Incoming Relation(s)
18(R)-HEPE(1−) (CHEBI:90818) is conjugate base of 18(R)-HEPE (CHEBI:81563)
18(S)-HEPE (CHEBI:132801) is enantiomer of 18(R)-HEPE (CHEBI:81563)
Synonyms  Source
18R-Hydroxy-5Z,8Z,11Z,14Z,16E-eicosapentaenoic acidKEGG COMPOUND
18-HEPEHMDB
18(R)-Hydroxyeicosa-5Z,8Z,11E,14Z,16E-pentaenoic acidHMDB
18R-HEPEChEBI
(5Z,8Z,11Z,14Z,16E,18R)-18-hydroxyicosapentaenoic acidChEBI
Manual XrefsDatabases
C18177KEGG COMPOUND
HMDB0012611HMDB
LMFA03070025LIPID MAPS
CPD66-68MetaCyc
Registry NumbersSources
Reaxys:21591942Reaxys
Citations