HMDB0031562
     RDKit          3D
2-Methyl-3-pentenoic acid
 18 17  0  0  0  0  0  0  0  0999 V2000
    1.9411    0.5727   -0.3449 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6527   -0.5108    0.5215 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4375   -0.8311    0.8294 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7383   -0.2037    0.3915 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6888   -1.3329   -0.1179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8953    0.9173   -0.4504 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3452    0.7950   -1.6428 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5852    2.2169   -0.0736 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3887    0.7782   -1.2420 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0216    0.4737   -0.7154 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0009    1.5243    0.2397 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5300   -1.0807    0.9332 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3180   -1.6993    1.5166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3076    0.0930    1.3531 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4651   -2.2698    0.3886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4887   -1.4217   -1.2099 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7302   -1.0588    0.0379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0462    3.0376   -0.4148 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  4  6  1  0
  6  7  2  0
  6  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  3 13  1  0
  4 14  1  0
  5 15  1  0
  5 16  1  0
  5 17  1  0
  8 18  1  0
M  END