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

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ChEBI Name 3-chloro-D-alanine zwitterion
ChEBI ID CHEBI:47291
ChEBI ASCII Name 3-chloro-D-alanine zwitterion
Definition Zwitterionic form of 3-chloro-D-alanine having an anionic carboxy group and a protonated amino group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C3H6ClNO2
Net Charge 0
Average Mass 123.53800
Monoisotopic Mass 123.00871
InChI InChI=1S/C3H6ClNO2/c4-1-2(5)3(6)7/h2H,1,5H2,(H,6,7)/t2-/m1/s1
InChIKey ASBJGPTTYPEMLP-UWTATZPHSA-N
SMILES [NH3+][C@H](CCl)C([O-])=O
ChEBI Ontology
Outgoing 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 3-chloro-D-alanine (CHEBI:17092) is tautomer of 3-chloro-D-alanine zwitterion (CHEBI:47291)
IUPAC Name
(2S)-2-azaniumyl-3-chloropropanoate
Synonym Source
3-chloro-D-alanine UniProt
Manual Xref Database
C2N PDBeChem
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Last Modified
11 September 2013