(4R,5R)-4,5-dihydroxy-2-oxo-6-(phosphonatooxy)hexanoate
  CDK    2/12/10,15:27

 16 15  0  0  0  0  0  0  0  0999 V2000
    4.9317   -0.9333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3562   -1.6407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9317   -2.3482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3562   -3.0556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9317   -3.7630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3562   -4.4705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1393   -0.9333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1485   -1.6407    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1485   -3.0556    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1393   -3.7630    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1485   -4.4705    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3562   -0.2259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0525   -4.4681    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    7.0357   -5.4589    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9283   -4.4849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0501   -3.6307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  7  1  1  0  0  0  0 
  2  1  1  0  0  0  0 
 12  1  2  0  0  0  0 
  8  2  2  0  0  0  0 
  3  2  1  0  0  0  0 
  4  3  1  0  0  0  0 
  4  9  1  1  0  0  0 
  5  4  1  0  0  0  0 
  5 10  1  1  0  0  0 
  6  5  1  0  0  0  0 
 11  6  1  0  0  0  0 
 13 11  1  0  0  0  0 
 15 13  1  0  0  0  0 
 16 13  1  0  0  0  0 
 14 13  2  0  0  0  0 
M  CHG  1   7  -1
M  CHG  1  15  -1
M  CHG  1  16  -1
M  END
> <ID>
CHEBI:58298

> <NAME>
6-phosphonato-2-dehydro-3-deoxy-D-galactate(3-)

> <DEFINITION>
An organophosphate oxoanion that is a trianion obtained via deprotonation of the carboxy and phosphate OH groups of 6-phospho-2-dehydro-3-deoxy-D-galactonic acid; major species at pH 7.3.

> <STAR>
3

> <SYNONYM>
6-phosphonato-2-dehydro-3-deoxy-D-galactate trianion; 6-phosphonato-2-dehydro-3-deoxy-D-galactate; 2-dehydro-3-deoxy-D-galactonate 6-phosphate; 2-dehydro-3-deoxy-6-phospho-D-galactonate

> <IUPAC_NAME>
3-deoxy-6-O-phosphonato-D-threo-hex-2-ulosonate

> <FORMULA>
C6H8O9P

> <MASS>
255.09610

> <MONOISOTOPIC_MASS>
254.99059

> <CHARGE>
-3

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

> <INCHI>
InChI=1S/C6H11O9P/c7-3(1-4(8)6(10)11)5(9)2-15-16(12,13)14/h3,5,7,9H,1-2H2,(H,10,11)(H2,12,13,14)/p-3/t3-,5-/m1/s1

> <INCHIKEY>
OVPRPPOVAXRCED-NQXXGFSBSA-K

> <REAXYS_REGISTRY_NUMBER>
6714584

> <PUBMED_CITATION>
17981470

$$$$