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CHEBI:169035 - Methyl DL-Leucate

ChEBI IDCHEBI:169035
ChEBI NameMethyl DL-Leucate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H14O3
Net Charge0
Average Mass146.186
Monoisotopic Mass146.09429
SMILESCOC(=O)C(O)CC(C)C
InChIInChI=1S/C7H14O3/c1-5(2)4-6(8)7(9)10-3/h5-6,8H,4H2,1-3H3
InChIKeyJOSNYUDSMPILKL-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 DL-Leucate (CHEBI:169035) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
methyl 2-hydroxy-4-methylpentanoate
Manual XrefsDatabases
56633ChemSpider
HMDB0036231HMDB
LMFA07010959LIPID MAPS
Registry NumbersSources
CAS:40348-72-9ChemIDplus