2-(1,2-dihydroxyethyl)-3,4,5-trioxooxolan-2-ide
  CDK    2/12/10,15:27

 12 12  0  0  0  0  0  0  0  0999 V2000
   16.2796  -14.2634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5332  -15.0510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9497  -13.7825    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4958  -14.0060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3625  -15.0510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0485  -15.7175    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.6124  -14.2634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3292  -13.1994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8472  -15.7136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3924  -14.0060    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9426  -12.6504    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8791  -14.5541    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0 
  1  3  1  0  0  0  0 
  1  4  1  0  0  0  0 
  5  2  1  0  0  0  0 
  2  6  2  0  0  0  0 
  3  7  1  0  0  0  0 
  4  8  1  0  0  0  0 
  4 12  1  0  0  0  0 
  5  9  2  0  0  0  0 
  7 10  2  0  0  0  0 
  8 11  1  0  0  0  0 
  7  5  1  0  0  0  0 
M  CHG  1   1  -1
M  END
> <ID>
CHEBI:58070

> <NAME>
dehydroascorbide(1-)

> <DEFINITION>
Conjugate base of dehydroascorbic acid arising from removal of the acidic proton at the  C-2 position; major species at pH 7.3.

> <STAR>
3

> <SYNONYM>
dehydroascorbide anion; dehydroascorbic acid anion; 2-(1,2-dihydroxyethyl)-3,4,5-trioxotetrahydrofuran-2-ide

> <IUPAC_NAME>
2-(1,2-dihydroxyethyl)-3,4,5-trioxooxolan-2-ide

> <FORMULA>
C6H5O6

> <MASS>
173.10030

> <MONOISOTOPIC_MASS>
173.00916

> <CHARGE>
-1

> <SMILES>
OCC(O)[C-]1OC(=O)C(=O)C1=O

> <INCHI>
InChI=1S/C6H5O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,7-8H,1H2/q-1

> <INCHIKEY>
OESHPIGALOBJLM-UHFFFAOYSA-N

> <METACYC_ACCESSION>
L-DEHYDRO-ASCORBATE

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