CHEBI:114126 - sodium hexanoate

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ChEBI Name sodium hexanoate ChEBI ID CHEBI:114126 Definition An organic sodium salt resulting from the replacement of the proton from the carboxy group of hexanoic acid by a sodium ion. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C6H11NaO2 Net Charge 0 Average Mass 138.140 Monoisotopic Mass 138.06567 InChI InChI=1S/C6H12O2.Na/c1-2-3-4-5-6(7)8;/h2-5H2,1H3,(H,7,8);/q;+1/p-1 InChIKey UDWXLZLRRVQONG-UHFFFAOYSA-M SMILES [Na+].CCCCCC([O-])=O Roles Classification Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). View more via ChEBI Ontology ChEBI Ontology Outgoing sodium hexanoate (CHEBI:114126) has part hexanoate (CHEBI:17120) sodium hexanoate (CHEBI:114126) has role human metabolite (CHEBI:77746) sodium hexanoate (CHEBI:114126) is a organic sodium salt (CHEBI:38700) IUPAC Name sodium hexanoate Synonyms Sources Hexanoic acid, sodium salt ChemIDplus Sodium caproate ChemIDplus Sodium capronate ChemIDplus Sodium n-caproate ChemIDplus Registry Numbers Types Sources 10051-44-2 CAS Registry Number ChemIDplus 3631527 Reaxys Registry Number Reaxys Citation Type Source 23871310 PubMed citation Europe PMC Last Modified 12 April 2016