CHEBI:188326 - ammonium isovalerate

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ChEBI Name ammonium isovalerate ChEBI ID CHEBI:188326 Definition An organic ammonium salt of isovaleric acid. Stars This entity has been manually annotated by the ChEBI Team. Submitter MetaboLights 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 C5H9O2.H4N Net Charge 0 Average Mass 119.164 Monoisotopic Mass 119.09463 InChI InChI=1S/C5H10O2.H3N/c1-4(2)3-5(6)7;/h4H,3H2,1-2H3,(H,6,7);1H3 InChIKey RKCHCKMAQPJXBM-UHFFFAOYSA-N SMILES [NH4+].CC(C)CC([O-])=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study Roles Classification Biological Role(s): flavouring agent A food additive that is used to added improve the taste or odour of a food. Application(s): flavouring agent A food additive that is used to added improve the taste or odour of a food. View more via ChEBI Ontology ChEBI Ontology Outgoing ammonium isovalerate (CHEBI:188326) has part isovalerate (CHEBI:48942) ammonium isovalerate (CHEBI:188326) has role flavouring agent (CHEBI:35617) ammonium isovalerate (CHEBI:188326) is a organic ammonium salt (CHEBI:143100) IUPAC Name ammonium 3-methylbutanoate Synonyms Sources 3-methylbutanoic acid ammonium salt ChEBI ammonium 3-methylbutyrate ChEBI azanium 3-methylbutanoate ChEBI FEMA 2054 ChEBI isovaleric acid ammonium salt ChEBI isovaleric acid, ammonium salt ChEBI Manual Xrefs Databases 55345 ChemSpider FDB017249 FooDB View more database links Registry Numbers Types Sources 33869685 Reaxys Registry Number Reaxys 7563-33-9 CAS Registry Number ChemIDplus Citations Types Sources 30619512 PubMed citation Europe PMC 32874247 PubMed citation Europe PMC Last Modified 18 January 2023