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CHEBI:168918 - Methyl (R)-3-methyl-2-oxopentanoate

ChEBI IDCHEBI:168918
ChEBI NameMethyl (R)-3-methyl-2-oxopentanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H12O3
Net Charge0
Average Mass144.170
Monoisotopic Mass144.07864
SMILESCCC(C)C(=O)C(=O)OC
InChIInChI=1S/C7H12O3/c1-4-5(2)6(8)7(9)10-3/h5H,4H2,1-3H3
InChIKeyZPSBJVARKCHQDF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Methyl (R)-3-methyl-2-oxopentanoate (CHEBI:168918) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
methyl 3-methyl-2-oxopentanoate
Manual XrefsDatabases
474461ChemSpider
HMDB0037114HMDB
LMFA07010933LIPID MAPS
Registry NumbersSources
CAS:3682-42-6ChemIDplus