HMDB0036380
     RDKit          3D
xi-2,3-Dihydro-3,5-dihydroxy-6-methyl-4H-pyran-4-one
 21 21  0  0  0  0  0  0  0  0999 V2000
    1.8836    2.0609    0.5009 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7764    0.7340    0.0607 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5542    0.0700   -0.0199 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4861   -1.2308   -0.2550 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7461   -2.0097   -0.4388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7490   -1.8438   -0.3260 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9008   -1.2309    0.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9079    0.1923   -0.3517 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0022    0.9090    0.1028 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6722    0.8186    0.1575 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6559    1.9312    0.7144 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5101    2.2155    1.5403 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3339    2.7254   -0.2122 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9785    2.3207    0.4391 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8045   -2.8434    0.2953 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8260   -2.3954   -1.4849 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6151   -1.3587   -0.2709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8198   -1.7665    0.0024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8137   -1.0933    1.3269 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8374    0.1543   -1.4502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1554    1.6407   -0.5505 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  8 10  1  0
 10 11  2  0
 10  3  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  5 15  1  0
  5 16  1  0
  5 17  1  0
  7 18  1  0
  7 19  1  0
  8 20  1  0
  9 21  1  0
M  END