5,6,8,9-tetrachloro-tetradecanoic acid (CHEBI:230586)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	5,6,8,9-tetrachloro-tetradecanoic acid

ChEBI ID	CHEBI:230586

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H24Cl4O2

Net Charge

Average Mass

366.140

Monoisotopic Mass

364.05304

InChI

InChI=1S/C14H24Cl4O2/c1-2-3-4-6-10(15)12(17)9-13(18)11(16)7-5-8-14(19)20/h10-13H,2-9H2,1H3,(H,19,20)

InChIKey

QHTKGYPZKJWJFA-UHFFFAOYSA-N

SMILES

ClC(CC(Cl)C(Cl)CCCC(O)=O)C(Cl)CCCCC

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in feces (BTO:0000440). See: MetaboLights Study

ChEBI Ontology
Outgoing	5,6,8,9-tetrachloro-tetradecanoic acid (CHEBI:230586) is a organic molecular entity (CHEBI:50860)

IUPAC Name

5,6,8,9-tetrachlorotetradecanoic acid