HMDB0031561
     RDKit          3D
4-Methyl-2-pentenoic acid
 18 17  0  0  0  0  0  0  0  0999 V2000
   -1.6672   -0.8610    0.4911 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5281    0.1585    0.1696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2716    1.4491   -0.1324 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1624   -0.3893   -0.9670 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4508   -0.5801   -1.0369 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3432   -0.2575    0.0323 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5893   -0.5138   -0.2001 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0671    0.2784    1.2521 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2300   -0.4863    1.3559 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2114   -1.8448    0.6245 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3016   -0.8382   -0.4133 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0462    0.2832    1.1194 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6138    2.3177   -0.2177 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9333    1.6330    0.7467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8787    1.2912   -1.0313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4320   -0.6847   -1.8783 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8772   -1.0201   -1.9866 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6238    0.0648    2.0720 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  2  0
  5  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
  3 14  1  0
  3 15  1  0
  4 16  1  0
  5 17  1  0
  8 18  1  0
M  END