HMDB0170858
     RDKit          3D
3-Methylbut-3-enoic acid
 15 14  0  0  0  0  0  0  0  0999 V2000
   -1.1449   -1.1040    0.9858 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6736   -0.0887    0.2923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3559    0.3395   -0.9382 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5590    0.6125    0.7764 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5439    0.4898   -0.3351 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8745    1.5522   -0.9702 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0741   -0.7452   -0.6554 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0317   -1.6007    0.6216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6265   -1.4010    1.8961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7588   -0.0553   -1.8181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4094   -0.0555   -0.9960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4021    1.4225   -1.0371 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3373    1.6615    1.0078 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0103    0.0487    1.6253 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0036   -1.0762   -0.4552 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  1  8  1  0
  1  9  1  0
  3 10  1  0
  3 11  1  0
  3 12  1  0
  4 13  1  0
  4 14  1  0
  7 15  1  0
M  END