CHEBI:132100 - sodium octanoate

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ChEBI Name sodium octanoate ChEBI ID CHEBI:132100 Definition An organic sodium salt comprising equal numbers of sodium and octanoate ions. 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 C8H15NaO2 Net Charge 0 Average Mass 166.194 Monoisotopic Mass 166.09697 InChI InChI=1S/C8H16O2.Na/c1-2-3-4-5-6-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+1/p-1 InChIKey BYKRNSHANADUFY-UHFFFAOYSA-M SMILES [Na+].C(CCCCCC)C(=O)[O-] ChEBI Ontology Outgoing sodium octanoate (CHEBI:132100) has part octanoate (CHEBI:25646) sodium octanoate (CHEBI:132100) is a organic sodium salt (CHEBI:38700) IUPAC Name sodium octanoate Synonyms Sources Caprylic acid sodium salt ChemIDplus Natrium octanoat ChemIDplus Octanoic acid, sodium salt ChemIDplus Sodium caprylate ChemIDplus Sodium n-octanoate ChemIDplus Registry Numbers Types Sources 1984-06-1 CAS Registry Number ChemIDplus 3597723 Reaxys Registry Number Reaxys Citations Types Sources 24470225 PubMed citation Europe PMC 26393372 PubMed citation Europe PMC 26617041 PubMed citation Europe PMC 27126474 PubMed citation Europe PMC Last Modified 01 June 2016