3-heptynoic acid (CHEBI:188196)

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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	3-heptynoic acid

ChEBI ID	CHEBI:188196

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C7H10O2

Net Charge

Average Mass

126.155

Monoisotopic Mass

126.06808

InChI

InChI=1S/C7H10O2/c1-2-3-4-5-6-7(8)9/h2-3,6H2,1H3,(H,8,9)

InChIKey

CVEHSFVOOYBVIX-UHFFFAOYSA-N

SMILES

OC(=O)CC#CCCC

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO:0000131). See: MetaboLights Study

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	3-heptynoic acid (CHEBI:188196) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name

hept-3-ynoic acid