(9E,11E)-octadecadienoic acid (CHEBI:88464)

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ChEBI Name	(9E,11E)-octadecadienoic acid

ChEBI ID	CHEBI:88464

ChEBI ASCII Name	(9E,11E)-octadecadienoic acid

Definition	An octadeca-9,11-dienoic acid having 9-trans,11-trans-stereochemistry.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information	ChemicalBook:CB2779788, eMolecules:6861851

Download	Molfile XML SDF

Formula

C18H32O2

Net Charge

Average Mass

280.452

Monoisotopic Mass

280.24023

InChI

InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h7-10H,2-6,11-17H2,1H3,(H,19,20)/b8-7+,10-9+

InChIKey

JBYXPOFIGCOSSB-XBLVEGMJSA-N

SMILES

OC(=O)CCCCCCC\C=C\C=C\CCCCCC

Metabolite of Species	Details
Lactobacillus acidophilus (NCBI:txid1579)	of strain AKU 1137 See: PubMed
Lactobacillus plantarum (NCBI:txid1590)	See: PubMed
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO_0000131). 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):	apoptosis inducer Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms. bacterial xenobiotic metabolite Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria. human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. anti-inflammatory agent Any compound that has anti-inflammatory effects. antiatherogenic agent A cardiovascular drug that prevents atherogenesis, the accumulation of lipid-containing plaques on the innermost layers of the arteries. Compare with antiatherosclerotic agent.

ChEBI Ontology
Outgoing	(9E,11E)-octadecadienoic acid (CHEBI:88464) has role anti-inflammatory agent (CHEBI:67079) (9E,11E)-octadecadienoic acid (CHEBI:88464) has role antiatherogenic agent (CHEBI:50855) (9E,11E)-octadecadienoic acid (CHEBI:88464) has role antineoplastic agent (CHEBI:35610) (9E,11E)-octadecadienoic acid (CHEBI:88464) has role apoptosis inducer (CHEBI:68495) (9E,11E)-octadecadienoic acid (CHEBI:88464) has role bacterial xenobiotic metabolite (CHEBI:76976) (9E,11E)-octadecadienoic acid (CHEBI:88464) has role human metabolite (CHEBI:77746) (9E,11E)-octadecadienoic acid (CHEBI:88464) is a octadeca-9,11-dienoic acid (CHEBI:36025) (9E,11E)-octadecadienoic acid (CHEBI:88464) is conjugate acid of (9E,11E)-octadecadienoate (CHEBI:194440)

Incoming	(9Z,11E)-9-hydroperoxyoctadeca-9,11-dienoic acid (CHEBI:144020) has functional parent (9E,11E)-octadecadienoic acid (CHEBI:88464) (9E,11E)-octadecadienoate (CHEBI:194440) is conjugate base of (9E,11E)-octadecadienoic acid (CHEBI:88464)

IUPAC Name

(9E,11E)-octadeca-9,11-dienoic acid

Synonyms	Sources
(9E,11E)-9,11-octadecadienoic acid	ChemIDplus
(E,E)-9,11-octadecadienoic acid	ChemIDplus
(E,E)-isolinoleic acid	ChEBI
9-trans, 11-trans-CLA	ChEBI
9-trans,11-trans-conjugated linoleic acid	ChEBI
9-trans,11-trans-octadecadienoic acid	ChemIDplus
9E,11E-CLA	ChEBI
9E,11E-octadecadienoic acid	ChEBI
9t,11t-CLA	ChEBI
conjugated (9E,11E)-linoleic acid	ChEBI
isolinoleic acid	ChemIDplus
Mangold's acid	LIPID MAPS
trans,trans-9,11-octadecadienoic acid	ChEBI
trans-9, trans-11-octadecadienoic acid	LIPID MAPS

Registry Number	Type	Source
544-71-8	CAS Registry Number	ChemIDplus

Last Modified

13 March 2023