HMDB0030056
     RDKit          3D
Isopropyl propionate
 20 19  0  0  0  0  0  0  0  0999 V2000
    3.2091   -0.3892    0.0377 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1914    0.4949   -0.6870 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9172    0.4426    0.0632 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9569    0.7351    1.2851 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2909    0.1015   -0.4622 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4537    0.0770    0.3292 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0558   -1.3214    0.3921 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4705    0.9595   -0.3515 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6527   -1.2879    0.4240 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5602    0.1872    0.9338 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0763   -0.6372   -0.5934 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0985    0.1714   -1.7252 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5313    1.5799   -0.6447 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2101    0.4014    1.3737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2950   -2.0992    0.1549 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9011   -1.4186   -0.3336 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5107   -1.4631    1.3934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3427    0.7788   -1.4473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1730    1.9985   -0.1475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4901    0.6889    0.0054 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
  3  5  1  0
  5  6  1  0
  6  7  1  0
  6  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  6 14  1  0
  7 15  1  0
  7 16  1  0
  7 17  1  0
  8 18  1  0
  8 19  1  0
  8 20  1  0
M  END