CHEBI:25646 - octanoate

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ChEBI Name octanoate
ChEBI ID CHEBI:25646
Definition A straight-chain saturated fatty acid anion that is the conjugate base of octanoic acid (caprylic acid); believed to block adipogenesis.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C8H15O2
Net Charge -1
Average Mass 143.204
Monoisotopic Mass 143.10775
InChI InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)/p-1
InChIKey WWZKQHOCKIZLMA-UHFFFAOYSA-M
SMILES C(CCCCCC)C(=O)[O-]
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing octanoate (CHEBI:25646) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
octanoate (CHEBI:25646) has role human metabolite (CHEBI:77746)
octanoate (CHEBI:25646) is a fatty acid anion 8:0 (CHEBI:78117)
octanoate (CHEBI:25646) is a straight-chain saturated fatty acid anion (CHEBI:58954)
octanoate (CHEBI:25646) is conjugate base of octanoic acid (CHEBI:28837)
Incoming 1,2-dioctanoyl-sn-glycero-3-phosphate(2−) (CHEBI:78229) has functional parent octanoate (CHEBI:25646)
1-octanoyl-sn-glycero-2,3-cyclic-phosphate(1−) (CHEBI:143876) has functional parent octanoate (CHEBI:25646)
1-octanoyl-sn-glycero-3-phosphocholine zwitterion (CHEBI:143866) has functional parent octanoate (CHEBI:25646)
2-oxooctanoate (CHEBI:176689) has functional parent octanoate (CHEBI:25646)
6-hydroxy-3,7-dimethyloctanoate (CHEBI:64223) has functional parent octanoate (CHEBI:25646)
8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate (CHEBI:15720) has functional parent octanoate (CHEBI:25646)
8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate (CHEBI:191855) has functional parent octanoate (CHEBI:25646)
N-octanoyl-3-ketodihydrosphingosine (CHEBI:189539) has functional parent octanoate (CHEBI:25646)
O-octanoyl-L-serine residue (CHEBI:143548) has functional parent octanoate (CHEBI:25646)
O-octanoyl-L-threonine residue (CHEBI:143547) has functional parent octanoate (CHEBI:25646)
dihydrolipoate (CHEBI:30316) has functional parent octanoate (CHEBI:25646)
lipoate (CHEBI:30313) has functional parent octanoate (CHEBI:25646)
sodium octanoate (CHEBI:132100) has part octanoate (CHEBI:25646)
octanoic acid (CHEBI:28837) is conjugate acid of octanoate (CHEBI:25646)
IUPAC Name
octanoate
Synonyms Sources
1-heptanecarboxylate ChEBI
caprilate ChEBI
caprylate ChEBI
CH3‒[CH2]6‒COO− ChEBI
n-caprylate ChEBI
n-octanoate ChEBI
n-octoate ChEBI
n-octylate ChEBI
octanoate UniProt
octanoate ChemIDplus
octanoic acid, ion(1−) ChemIDplus
octylate ChEBI
Manual Xref Database
c0047 UM-BBD
View more database links
Registry Numbers Types Sources
329219 Gmelin Registry Number Gmelin
3588079 Beilstein Registry Number Beilstein
3588079 Reaxys Registry Number Reaxys
74-81-7 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
11983812 PubMed citation Europe PMC
Last Modified
13 May 2022