CHEBI:72639 - 13-HODE

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ChEBI Name 13-HODE
ChEBI ID CHEBI:72639
Definition A HODE that consists of 9Z,11E-octadecadienoic acid carrying a 13-hydroxy substituent.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C18H32O3
Net Charge 0
Average Mass 296.446
Monoisotopic Mass 296.23514
InChI InChI=1S/C18H32O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7-,15-12+
InChIKey HNICUWMFWZBIFP-BSZOFBHHSA-N
SMILES C(CCCCCCC/C=C\C=C\C(CCCCC)O)(=O)O
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): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing 13-HODE (CHEBI:72639) has role metabolite (CHEBI:25212)
13-HODE (CHEBI:72639) is a HODE (CHEBI:36328)
13-HODE (CHEBI:72639) is conjugate acid of 13-HODE(1−) (CHEBI:133819)
Incoming 13-oxo-9Z,11E-ODE (CHEBI:68947) has functional parent 13-HODE (CHEBI:72639)
13(R)-HODE (CHEBI:137495) is a 13-HODE (CHEBI:72639)
13-HODE(1−) (CHEBI:133819) is conjugate base of 13-HODE (CHEBI:72639)
IUPAC Name
(9Z,11E)-13-hydroxyoctadeca-9,11-dienoic acid
Synonyms Sources
13-hydroxy-9Z,11E-octadecadienoic acid LIPID MAPS
13-hydroxy-cis-9,trans-11-octadecadienoic acid LIPID MAPS
Coriolic acid LIPID MAPS
Manual Xref Database
LMFA02000154 LIPID MAPS
View more database links
Registry Number Type Source
1913985 Reaxys Registry Number Reaxys
Last Modified
22 June 2017