heptanoate (CHEBI:32362)

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ChEBI Name	heptanoate

ChEBI ID	CHEBI:32362

Definition	A medium-chain fatty acid anion that is the conjugate base of heptanoic acid; shown in myocardial ischaemia/reperfusion studies to increase levels of C₄ Kreb's cycle intermediates.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

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Formula

C7H13O2

Net Charge

-1

Average Mass

129.17692

Monoisotopic Mass

129.09210

InChI

InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)/p-1

InChIKey

MNWFXJYAOYHMED-UHFFFAOYSA-M

SMILES

CCCCCCC([O-])=O

Roles Classification
Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	heptanoate (CHEBI:32362) has role plant metabolite (CHEBI:76924) heptanoate (CHEBI:32362) is a medium-chain fatty acid anion (CHEBI:59558) heptanoate (CHEBI:32362) is a straight-chain saturated fatty acid anion (CHEBI:58954) heptanoate (CHEBI:32362) is conjugate base of heptanoic acid (CHEBI:45571)

Incoming	1-heptanoyl-2-hexanoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:138217) has functional parent heptanoate (CHEBI:32362) 2,4,6-trioxoheptanoate (CHEBI:19338) has functional parent heptanoate (CHEBI:32362) 3-isopropenyl-6-oxoheptanoate (CHEBI:64234) has functional parent heptanoate (CHEBI:32362) O-heptanoyl-L-serine residue (CHEBI:177290) has functional parent heptanoate (CHEBI:32362) heptanoic acid (CHEBI:45571) is conjugate acid of heptanoate (CHEBI:32362)

IUPAC Name

heptanoate

Citation	Type	Source
16141384	PubMed citation	Europe PMC

Last Modified

27 September 2016