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CHEBI:34497 - 9(S)-HPETE

ChEBI IDCHEBI:34497
ChEBI Name9(S)-HPETE
Stars
ASCII Name9(S)-HPETE
DefinitionA 9-HPETE in which the 9-hydroxy group has S stereochemistry.
Last Modified27 January 2016
DownloadsMolfile
FormulaC20H32O4
Net Charge0
Average Mass336.472
Monoisotopic Mass336.23006
SMILESCCCCC/C=C\C/C=C\C[C@@H](/C=C/C=C\CCCC(=O)O)OO
InChIInChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-10-13-16-19(24-23)17-14-11-9-12-15-18-20(21)22/h6-7,9-11,13-14,17,19,23H,2-5,8,12,15-16,18H2,1H3,(H,21,22)/b7-6-,11-9-,13-10-,17-14+/t19-/m0/s1
InChIKeyLIYCOTUUWOESJK-VBLHFSPLSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
9(S)-HPETE (CHEBI:34497) has functional parent icosa-5,7,11,14-tetraenoic acid (CHEBI:36232)
9(S)-HPETE (CHEBI:34497) has role mouse metabolite (CHEBI:75771)
9(S)-HPETE (CHEBI:34497) is a 9-HPETE (CHEBI:78732)
9(S)-HPETE (CHEBI:34497) is conjugate acid of 9(S)-HPETE(1−) (CHEBI:146290)
9(S)-HPETE (CHEBI:34497) is enantiomer of 9(R)-HPETE (CHEBI:78731)
Incoming Relation(s)
9(S)-HPETE(1−) (CHEBI:146290) is conjugate base of 9(S)-HPETE (CHEBI:34497)
9(R)-HPETE (CHEBI:78731) is enantiomer of 9(S)-HPETE (CHEBI:34497)
IUPAC Name 
(5Z,7E,9S,11Z,14Z)-9-hydroperoxyicosa-5,7,11,14-tetraenoic acid
Synonyms  Source
9(S)-HPETEKEGG COMPOUND
(5Z,7E,11Z,14Z)-(9S)-9-Hydroperoxyeicosa-5,7,11,14-tetraenoic acidKEGG COMPOUND
(5Z,7E,11Z,14Z)-(9S)-9-Hydroperoxyicosa-5,7,11,14-tetraenoic acidKEGG COMPOUND
Manual XrefsDatabases
C14821KEGG COMPOUND
LMFA03060072LIPID MAPS