ChEBI
  Marvin  12160511092D          

  6  5  0  0  1  0            999 V2000
   15.5794  -12.3704    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   14.8650  -11.9579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8650  -11.1329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1505  -12.3704    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   14.1505  -13.1954    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.4360  -11.9579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  2  1  0  0  0  0
  4  5  1  6  0  0  0
  6  4  1  0  0  0  0
M  CHG  1   1  -1
M  END
> <ID>
CHEBI:32435

> <NAME>
D-alaninate

> <DEFINITION>
The D-enantiomer of alaninate.

> <STAR>
3

> <SYNONYM>
D-alanine anion; (2R)-2-aminopropanoate

> <IUPAC_NAME>
D-alaninate

> <FORMULA>
C3H6NO2

> <MASS>
88.08528

> <MONOISOTOPIC_MASS>
88.04040

> <CHARGE>
-1

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

> <INCHI>
InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/p-1/t2-/m1/s1

> <INCHIKEY>
QNAYBMKLOCPYGJ-UWTATZPHSA-M

> <BEILSTEIN_REGISTRY_NUMBER>
4781244

> <GMELIN_REGISTRY_NUMBER>
745914

$$$$