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CHEBI:34496 - 9(S)-HODE

ChEBI IDCHEBI:34496
ChEBI Name9(S)-HODE
Stars
ASCII Name9(S)-HODE
DefinitionA 9-HODE in which the 9-hydroxy group has S-stereochemistry.
Secondary ChEBI IDCHEBI:68946
Last Modified21 October 2024
DownloadsMolfile
FormulaC18H32O3
Net Charge0
Average Mass296.451
Monoisotopic Mass296.23514
SMILESCCCCC/C=C\C=C\[C@@H](O)CCCCCCCC(=O)O
InChIInChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+/t17-/m1/s1
InChIKeyNPDSHTNEKLQQIJ-UINYOVNOSA-N
Species of MetaboliteComponentSourceComments
Carthamus oxyacantha (ncbitaxon:122010) aerial part (BTO:0001658) PubMed (22060189) Crude ethanolic extract of aerial parts
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).
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
9(S)-HODE (CHEBI:34496) is a 9-HODE (CHEBI:72651)
9(S)-HODE (CHEBI:34496) is conjugate acid of 9(S)-HODE(1−) (CHEBI:77852)
9(S)-HODE (CHEBI:34496) is enantiomer of 9(R)-HODE (CHEBI:78730)
Incoming Relation(s)
9(S)-HODE(1−) (CHEBI:77852) is conjugate base of 9(S)-HODE (CHEBI:34496)
9(R)-HODE (CHEBI:78730) is enantiomer of 9(S)-HODE (CHEBI:34496)
IUPAC Name 
(9S,10E,12Z)-9-hydroxyoctadeca-10,12-dienoic acid
Synonyms  Source
9(S)-HODEKEGG COMPOUND
(9S)-Hydroxyoctadecadinoiec acidKEGG COMPOUND
(10E,12Z)-(9S)-9-Hydroxyoctadeca-10,12-dienoic acidKEGG COMPOUND
9-hydroxy-trans-10,cis-12-octadecadienoic acidChEBI
(9S)-Hydroxyoctadecadienoic acidKEGG COMPOUND
alpha-dimorphecolicHMDB
Manual XrefsDatabases
C14767KEGG COMPOUND
LMFA01050278LIPID MAPS
HMDB0004670HMDB
9HOPDBeChem
Registry NumbersSources
Reaxys:1914445Reaxys
CAS:73543-67-6KEGG COMPOUND
Citations