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CHEBI:47291 - 3-chloro-D-alanine zwitterion

ChEBI IDCHEBI:47291
ChEBI Name3-chloro-D-alanine zwitterion
Stars
ASCII Name3-chloro-D-alanine zwitterion
DefinitionZwitterionic form of 3-chloro-D-alanine having an anionic carboxy group and a protonated amino group; major species at pH 7.3.
Last Modified11 September 2013
DownloadsMolfile
FormulaC3H6ClNO2
Net Charge0
Average Mass123.539
Monoisotopic Mass123.00871
SMILES[NH3+][C@H](CCl)C(=O)[O-]
InChIInChI=1S/C3H6ClNO2/c4-1-2(5)3(6)7/h2H,1,5H2,(H,6,7)/t2-/m1/s1
InChIKeyASBJGPTTYPEMLP-UWTATZPHSA-N
ChEBI Ontology
Outgoing Relation(s)
3-chloro-D-alanine zwitterion (CHEBI:47291) is a amino-acid zwitterion (CHEBI:35238)
3-chloro-D-alanine zwitterion (CHEBI:47291) is a organochlorine compound (CHEBI:36683)
3-chloro-D-alanine zwitterion (CHEBI:47291) is tautomer of 3-chloro-D-alanine (CHEBI:17092)
Incoming Relation(s)
3-chloro-D-alanine (CHEBI:17092) is tautomer of 3-chloro-D-alanine zwitterion (CHEBI:47291)
IUPAC Name 
(2S)-2-azaniumyl-3-chloropropanoate
UniProt Name  Source
3-chloro-D-alanineUniProt
Manual XrefsDatabases
C2NPDBeChem