(2S)-2-azaniumylpropanoate
  CDK    2/12/10,15:27

  6  5  0  0  0  0  0  0  0  0999 V2000
    1.8187    0.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1042   -0.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5331   -0.1875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8187    1.0500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1042   -1.0125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3897    0.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0 
  4  1  2  0  0  0  0 
  3  1  1  0  0  0  0 
  2  6  1  0  0  0  0 
  2  5  1  1  0  0  0 
M  CHG  1   3  -1
M  CHG  1   5   1
M  END
> <ID>
CHEBI:57972

> <NAME>
L-alanine zwitterion

> <DEFINITION>
Zwitterionic form of L-alanine arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3.

> <STAR>
3

> <SYNONYM>
L-alanine; (2S)-2-ammoniopropanoate

> <IUPAC_NAME>
(2S)-2-azaniumylpropanoate

> <FORMULA>
C3H7NO2

> <MASS>
89.09320

> <MONOISOTOPIC_MASS>
89.04768

> <CHARGE>
0

> <SMILES>
C[C@H]([NH3+])C([O-])=O

> <INCHI>
InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1

> <INCHIKEY>
QNAYBMKLOCPYGJ-REOHCLBHSA-N

> <GMELIN_REGISTRY_NUMBER>
362662

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