CHEBI:72651 - 9-HODE

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ChEBI Name 9-HODE
ChEBI ID CHEBI:72651
Definition A HODE that consists of (10E,12Z)-octadecadienoic acid with the hydroxy substituent located at position 9.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
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Formula C18H32O3
Net Charge 0
Average Mass 296.44490
Monoisotopic Mass 296.23514
InChI InChI=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+
InChIKey NPDSHTNEKLQQIJ-ZJHFMPGASA-N
SMILES CCCCC\C=C/C=C/C(O)CCCCCCCC(O)=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) See: MetaboLights Study
Valeriana fauriei (NCBI:txid105907) from ethanolic extract See: PubMed
Homo sapiens (NCBI:txid9606) See: PubMed
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): 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).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 9-HODE (CHEBI:72651) has role human metabolite (CHEBI:77746)
9-HODE (CHEBI:72651) has role mouse metabolite (CHEBI:75771)
9-HODE (CHEBI:72651) has role plant metabolite (CHEBI:76924)
9-HODE (CHEBI:72651) is a HODE (CHEBI:36328)
9-HODE (CHEBI:72651) is a octadecadienoic acid (CHEBI:25627)
9-HODE (CHEBI:72651) is conjugate acid of 9-HODE(1−) (CHEBI:133820)
Incoming 9-oxo-ODE (CHEBI:72842) has functional parent 9-HODE (CHEBI:72651)
9(R)-HODE (CHEBI:78730) is a 9-HODE (CHEBI:72651)
9(S)-HODE (CHEBI:34496) is a 9-HODE (CHEBI:72651)
9-HODE(1−) (CHEBI:133820) is conjugate base of 9-HODE (CHEBI:72651)
IUPAC Name
(10E,12Z)-9-hydroxyoctadeca-10,12-dienoic acid
Synonyms Sources
(10E,12Z)-9-HODE ChEBI
9-hydroxy-10E,12Z-octadecadienoic acid LIPID MAPS
9-hydroxy-trans-10,cis-12-octadecadienoic acid LIPID MAPS
Manual Xref Database
LMFA02000151 LIPID MAPS
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Registry Number Type Source
1914445 Reaxys Registry Number Reaxys
Citations Waiting for Citations
Last Modified
21 October 2024