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CHEBI:167610 - 3-methylvalerate

ChEBI IDCHEBI:167610
ChEBI Name3-methylvalerate
Stars
DefinitionA monocarboxylic acid anion that is the conjugate base of 3-methylvaleric acid, resulting from the deprotonation of the carboxy group. Major species at pH 7.3.
Last Modified12 March 2021
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC6H11O2
Net Charge-1
Average Mass115.152
Monoisotopic Mass115.07645
SMILESCCC(C)CC(=O)[O-]
InChIInChI=1S/C6H12O2/c1-3-5(2)4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8)/p-1
InChIKeyIGIDLTISMCAULB-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
3-methylvalerate (CHEBI:167610) is a branched-chain saturated fatty acid anion (CHEBI:58956)
3-methylvalerate (CHEBI:167610) is a methyl-branched fatty acid anion (CHEBI:67013)
3-methylvalerate (CHEBI:167610) is a monocarboxylic acid anion (CHEBI:35757)
3-methylvalerate (CHEBI:167610) is a short-chain fatty acid anion (CHEBI:58951)
3-methylvalerate (CHEBI:167610) is conjugate base of 3-methylvaleric acid (CHEBI:166883)
Incoming Relation(s)
3-methylvaleric acid (CHEBI:166883) is conjugate acid of 3-methylvalerate (CHEBI:167610)
IUPAC Name 
3-methylpentanoate
Synonyms  Source
3-methylvalerateSUBMITTER
β-methylvalerateChEBI
UniProt Name  Source
3-methylpentanoateUniProt
Citations