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CHEBI:90822 - 5-HPETE(1−)

ChEBI IDCHEBI:90822
ChEBI Name5-HPETE(1−)
Stars
ASCII Name5-HPETE(1-)
DefinitionA HPETE anion that is the conjugate base of 5-HPETE arising from deprotonation of the carboxylic acid function; major species at pH 7.3.
Last Modified19 February 2016
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC20H31O4
Net Charge-1
Average Mass335.464
Monoisotopic Mass335.22278
SMILESCCCCC/C=C\C/C=C\C/C=C\C=C\C(CCCC(=O)[O-])OO
InChIInChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(24-23)17-15-18-20(21)22/h6-7,9-10,12-14,16,19,23H,2-5,8,11,15,17-18H2,1H3,(H,21,22)/p-1/b7-6-,10-9-,13-12-,16-14+
InChIKeyJNUUNUQHXIOFDA-XTDASVJISA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (10542053)
Roles Classification
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
5-HPETE(1−) (CHEBI:90822) has role human xenobiotic metabolite (CHEBI:76967)
5-HPETE(1−) (CHEBI:90822) is a HPETE anion (CHEBI:59720)
5-HPETE(1−) (CHEBI:90822) is conjugate base of 5-HPETE (CHEBI:91268)
Incoming Relation(s)
5(R)-HPETE(1−) (CHEBI:193570) is a 5-HPETE(1−) (CHEBI:90822)
5-HPETE (CHEBI:91268) is conjugate acid of 5-HPETE(1−) (CHEBI:90822)
IUPAC Name 
(6E,8Z,11Z,14Z)-5-hydroperoxyicosa-6,8,11,14-tetraenoate
Synonyms  Source
5-hydroperoxy-(6E,8Z,11Z,14Z)-icosatetraenoateChEBI
(6E,8Z,11Z,14Z)-5-hydroperoxyicosatetraenoateChEBI
UniProt Name  Source
5-hydroperoxy-(6E,8Z,11Z,14Z)-eicosatetraenoateUniProt
Citations