7-oxo-11E,13-Tetradecadienoic acid (CHEBI:168724)

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CHEBI:168724 - 7-oxo-11E,13-Tetradecadienoic acid

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ChEBI ID	CHEBI:168724
ChEBI Name	7-oxo-11E,13-Tetradecadienoic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C14H22O3
Net Charge	0
Average Mass	238.327
Monoisotopic Mass	238.15689
SMILES	C=C/C=C/CCCC(=O)CCCCCC(=O)O
InChI	InChI=1S/C14H22O3/c1-2-3-4-5-7-10-13(15)11-8-6-9-12-14(16)17/h2-4H,1,5-12H2,(H,16,17)/b4-3+
InChIKey	UXENOYDVEDGVDV-ONEGZZNKSA-N

Species of Metabolite	Component	Source	Comments
Malus domestica (ncbitaxon:3750)	exocarp (BTO:0000733)	MetaboLights (MTBLS2384)	Strain: Malus x domestica Borkh. cv. Ruixue

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	7-oxo-11E,13-Tetradecadienoic acid (CHEBI:168724) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name
(11E)-7-oxotetradeca-11,13-dienoic acid

Manual Xrefs	Databases
24841872	ChemSpider
LMFA01060185	LIPID MAPS