HMDB0040433
     RDKit          3D
Ethyl levulinate
 22 21  0  0  0  0  0  0  0  0999 V2000
    3.5184    0.2701   -0.6430 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1325   -0.2414    0.7112 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8210    0.1199    1.0980 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7368   -0.2894    0.3319 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9897   -0.9784   -0.6909 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6673    0.0801    0.7175 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5763   -0.5277   -0.3319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9955   -0.2597   -0.1055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6848    0.7596   -0.9305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6057   -0.8640    0.7485 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6681    0.5278   -1.2928 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1911   -0.4736   -1.1376 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1608    1.1774   -0.5014 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8547    0.0690    1.4961 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2161   -1.3651    0.6817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7840    1.1795    0.7952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8338   -0.3606    1.7281 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2102   -0.1337   -1.3169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3370   -1.6266   -0.3399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9464    0.2576   -1.8964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6366    1.0550   -0.4527 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0117    1.6244   -1.0758 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  8 10  2  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  6 16  1  0
  6 17  1  0
  7 18  1  0
  7 19  1  0
  9 20  1  0
  9 21  1  0
  9 22  1  0
M  END