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CHEBI:233916 - N-butyryl-isoleucine

ChEBI IDCHEBI:233916
ChEBI NameN-butyryl-isoleucine
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SubmitterMetaboLights
DownloadsMolfile
FormulaC10H19NO3
Net Charge0
Average Mass201.266
Monoisotopic Mass201.13649
SMILESCCCC(=O)N[C@H](C(=O)O)[C@@H](C)CC
InChIInChI=1S/C10H19NO3/c1-4-6-8(12)11-9(10(13)14)7(3)5-2/h7,9H,4-6H2,1-3H3,(H,11,12)(H,13,14)/t7-,9-/m0/s1
InChIKeyANKPSSPTFFQSKS-CBAPKCEASA-N
ChEBI Ontology
Outgoing Relation(s)
N-butyryl-isoleucine (CHEBI:233916) is a isoleucine derivative (CHEBI:24899)
IUPAC Name 
(2S,3S)-2-(butanoylamino)-3-methylpentanoic acid
Manual XrefsDatabases
63003696ChemSpider