2-hydroxy-3-oxopropanoate
  Marvin  11101016222D          

  8  7  0  0  0  0            999 V2000
    5.2276   -3.2722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9413   -3.6860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2276   -2.4449    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5139   -3.6860    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    5.9413   -4.5134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6554   -2.4383    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6549   -3.2722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3696   -3.6842    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  4  1  1  0  0  0  0
  3  1  2  0  0  0  0
  7  2  1  0  0  0  0
  5  2  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
M  CHG  1   4  -1
M  END
> <ID>
CHEBI:57978

> <NAME>
2-hydroxy-3-oxopropanoate

> <DEFINITION>
The conjugate base of 2-hydroxy-3-oxopropanoic acid; major species at pH 7.3.

> <STAR>
3

> <SYNONYM>
2-hydroxy-3-oxopropanoate(1-); 2-hydroxy-3-oxopropanoate anion; 2-hydroxy-3-oxopropanoate

> <IUPAC_NAME>
2-hydroxy-3-oxopropanoate

> <FORMULA>
C3H3O4

> <MASS>
103.05350

> <MONOISOTOPIC_MASS>
103.00368

> <CHARGE>
-1

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

> <INCHI>
InChI=1S/C3H4O4/c4-1-2(5)3(6)7/h1-2,5H,(H,6,7)/p-1

> <INCHIKEY>
QWBAFPFNGRFSFB-UHFFFAOYSA-M

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