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CHEBI:173695 - O-Desmethyl-lacosamide

ChEBI IDCHEBI:173695
ChEBI NameO-Desmethyl-lacosamide
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16N2O3
Net Charge0
Average Mass236.271
Monoisotopic Mass236.11609
SMILESCC(=O)N[C@H](CO)C(=O)NCc1ccccc1
InChIInChI=1S/C12H16N2O3/c1-9(16)14-11(8-15)12(17)13-7-10-5-3-2-4-6-10/h2-6,11,15H,7-8H2,1H3,(H,13,17)(H,14,16)/t11-/m1/s1
InChIKeyXRKSCJLQKGLSKU-LLVKDONJSA-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)
O-Desmethyl-lacosamide (CHEBI:173695) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
(2R)-2-acetamido-N-benzyl-3-hydroxypropanamide
Manual XrefsDatabases
HMDB0060855HMDB
9065165ChemSpider
Registry NumbersSources
CAS:175481-38-6ChemIDplus