2,4,6-Octatriynoic acid (CHEBI:185052)

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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	2,4,6-Octatriynoic acid

ChEBI ID	CHEBI:185052

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C8H4O2

Net Charge

Average Mass

132.118

Monoisotopic Mass

132.02113

InChI

InChI=1S/C8H4O2/c1-2-3-4-5-6-7-8(9)10/h1H3,(H,9,10)

InChIKey

GYUOOLGIYHUJRP-UHFFFAOYSA-N

SMILES

OC(=O)C#CC#CC#CC

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
Psathyrella (NCBI:txid71729)	See: DOI

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	2,4,6-Octatriynoic acid (CHEBI:185052) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Names

methyl octa-2,4,6-triynoate

octa-2,4,6-triynoic acid