CHEBI:72808 - 13-hydroxy-6Z,9Z,11E-octadecatrienoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 13-hydroxy-6Z,9Z,11E-octadecatrienoic acid
ChEBI ID CHEBI:72808
ChEBI ASCII Name 13-hydroxy-6Z,9Z,11E-octadecatrienoic acid
Definition A hydroxyoctadecatrienoic acid that consists of 6Z,9Z,11E-octadecatrienoic acid having the hydroxy group located at position 13.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C18H30O3
Net Charge 0
Average Mass 294.42900
Monoisotopic Mass 294.21949
InChI InChI=1S/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h4,6-7,9,12,15,17,19H,2-3,5,8,10-11,13-14,16H2,1H3,(H,20,21)/b6-4-,9-7-,15-12+
InChIKey HNBLUNXZQNJFRB-YSHIPJNPSA-N
SMILES CCCCCC(O)\C=C\C=C/C\C=C/CCCCC(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.
(via HOTrE )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 13-hydroxy-6Z,9Z,11E-octadecatrienoic acid (CHEBI:72808) has role metabolite (CHEBI:25212)
13-hydroxy-6Z,9Z,11E-octadecatrienoic acid (CHEBI:72808) is a HOTrE (CHEBI:72804)
IUPAC Name
(6Z,9Z,11E)-13-hydroxyoctadeca-6,9,11-trienoic acid
Synonym Source
13-HOTrE(γ) ChEBI
Registry Number Type Source
15525483 Reaxys Registry Number Reaxys
Last Modified
16 April 2013