Marvin  12061014372D          

 11 10  0  0  1  0            999 V2000
   11.9497   -6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2354   -6.7128    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.5369   -6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9497   -5.4746    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6640   -6.7128    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    9.8067   -6.7128    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2354   -7.5224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5210   -7.9351    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   10.1241   -7.2207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8067   -8.3320    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   10.9338   -8.6494    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  5  1  1  0  0  0  0
  4  1  2  0  0  0  0
  2  3  1  0  0  0  0
  2  7  1  6  0  0  0
  6  3  1  0  0  0  0
  8  7  1  0  0  0  0
 10  8  1  0  0  0  0
 11  8  1  0  0  0  0
  9  8  2  0  0  0  0
M  CHG  3   5  -1  10  -1  11  -1
M  END
> <ID>
CHEBI:58289

> <NAME>
2-phosphonato-D-glycerate(3-)

> <DEFINITION>
An organophosphate oxoanion arising from deprotonation of the phosphate OH and carboxy groups of 2-phospho-D-glyceric acid; major species at pH 7.3.

> <STAR>
3

> <SYNONYM>
2-phosphonato-D-glycerate trianion; 2-phosphonato-D-glycerate; (2R)-2-phosphoglycerate

> <IUPAC_NAME>
(2R)-3-hydroxy-2-(phosphonatooxy)propanoate

> <FORMULA>
C3H4O7P

> <MASS>
183.03340

> <MONOISOTOPIC_MASS>
182.97111

> <CHARGE>
-3

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

> <INCHI>
InChI=1S/C3H7O7P/c4-1-2(3(5)6)10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)/p-3/t2-/m1/s1

> <INCHIKEY>
GXIURPTVHJPJLF-UWTATZPHSA-K

> <METACYC_ACCESSION>
2-PG

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