CHEBI:191147 - N-benzyl-l-isoleucine methyl ester

ChEBI IDCHEBI:191147
ChEBI NameN-benzyl-l-isoleucine methyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H21NO2
Net Charge0
Average Mass235.327
Monoisotopic Mass235.15723
SMILESCC[C@H](C)[C@H](NCc1ccccc1)C(=O)OC
InChIInChI=1S/C14H21NO2/c1-4-11(2)13(14(16)17-3)15-10-12-8-6-5-7-9-12/h5-9,11,13,15H,4,10H2,1-3H3/t11-,13-/m0/s1
InChIKeyPTFWBRJIWLYMTF-AAEUAGOBSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) INS-1 cell (BTO:0002135) MetaboLights (MTBLS3963)
ChEBI Ontology
Outgoing Relation(s)
N-benzyl-l-isoleucine methyl ester (CHEBI:191147) is a isoleucine derivative (CHEBI:24899)
IUPAC Name 
methyl (2S,3S)-2-(benzylamino)-3-methylpentanoate
Manual XrefsDatabases
57618952ChemSpider