7-Acetoxy-2E,4E,6E-tetradecatrienoic acid (CHEBI:187839)

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CHEBI:187839 - 7-Acetoxy-2E,4E,6E-tetradecatrienoic acid

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ChEBI ID	CHEBI:187839
ChEBI Name	7-Acetoxy-2E,4E,6E-tetradecatrienoic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C16H24O4
Net Charge	0
Average Mass	280.364
Monoisotopic Mass	280.16746
SMILES	CCCCCCC/C(=C/C=C/C=C/C(=O)O)OC(C)=O
InChI	InChI=1S/C16H24O4/c1-3-4-5-6-8-11-15(20-14(2)17)12-9-7-10-13-16(18)19/h7,9-10,12-13H,3-6,8,11H2,1-2H3,(H,18,19)/b9-7+,13-10+,15-12-
InChIKey	NUHFPEGLUIBUQT-XHFJTRGNSA-N

Species of Metabolite	Component	Source	Comments
Mus musculus (ncbitaxon:10090)	feces (BTO:0000440)	MetaboLights (MTBLS3750)	Strain: C57BL/6 Mouse [NCIT:C14424]

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	7-Acetoxy-2E,4E,6E-tetradecatrienoic acid (CHEBI:187839) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name
(2E,4E,6Z)-7-acetyloxytetradeca-2,4,6-trienoic acid

Manual Xrefs	Databases
113368283	ChemSpider
LMFA01050544	LIPID MAPS