HMDB0033129
     RDKit          3D
3-Acetyl-4-hydroxy-6-methyl-2H-pyran-2-one
 20 20  0  0  0  0  0  0  0  0999 V2000
    3.1641    0.2314    0.4362 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2548   -0.4387   -0.5224 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7338   -1.1352   -1.4525 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8034   -0.3141   -0.4194 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1945    0.4287    0.5679 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9580    1.0982    1.5186 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1954    0.4811    0.5752 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9740   -0.1740   -0.3565 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4623   -0.1073   -0.3343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3351   -0.8649   -1.2715 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0271   -0.9445   -1.3197 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5437   -1.6308   -2.2315 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2051   -0.0831    0.2441 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0356    1.3238    0.4771 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9058   -0.1872    1.4523 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4610    1.6287    2.2208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6887    1.0523    1.3332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8581   -1.0769   -0.7136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8543   -0.0169    0.7030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8646    0.7295   -0.9071 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
  5  7  1  0
  7  8  2  0
  8  9  1  0
  8 10  1  0
 10 11  1  0
 11 12  2  0
 11  4  1  0
  1 13  1  0
  1 14  1  0
  1 15  1  0
  6 16  1  0
  7 17  1  0
  9 18  1  0
  9 19  1  0
  9 20  1  0
M  END