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CHEBI:151108 - N-Acetyl-D-isoleucine

ChEBI IDCHEBI:151108
ChEBI NameN-Acetyl-D-isoleucine
Stars
Submittermwilliams
DownloadsMolfile
FormulaC8H15NO3
Net Charge0
Average Mass173.212
Monoisotopic Mass173.10519
SMILESCC[C@@H](C)[C@@H](NC(C)=O)C(=O)O
InChIInChI=1S/C8H15NO3/c1-4-5(2)7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t5-,7-/m1/s1
InChIKeyJDTWZSUNGHMMJM-IYSWYEEDSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) cell lysate (BTO:0004304) MetaboLights (MTBLS1079) Strain: Escherichia coli str. K-12 substr. DH10B [NCBITAXON:316385]
ChEBI Ontology
Outgoing Relation(s)
N-Acetyl-D-isoleucine (CHEBI:151108) is a isoleucine derivative (CHEBI:24899)
IUPAC Name 
(2R,3R)-2-acetamido-3-methylpentanoic acid