EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:174013 - N-lactoyl-Isoeucine

ChEBI IDCHEBI:174013
ChEBI NameN-lactoyl-Isoeucine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H18O4
Net Charge0
Average Mass202.250
Monoisotopic Mass202.12051
SMILESCC[C@@H](C)[C@H](CC(=O)[C@H](C)O)C(=O)O
InChIInChI=1S/C10H18O4/c1-4-6(2)8(10(13)14)5-9(12)7(3)11/h6-8,11H,4-5H2,1-3H3,(H,13,14)/t6-,7+,8+/m1/s1
InChIKeyDYYQDDUCQLULFE-CSMHCCOUSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
N-lactoyl-Isoeucine (CHEBI:174013) is a oxo carboxylic acid (CHEBI:25754)
IUPAC Name 
(2S,5S)-2-[(2R)-butan-2-yl]-5-hydroxy-4-oxohexanoic acid
Manual XrefsDatabases
59664335ChemSpider
HMDB0062180HMDB