HMDB0059731
     RDKit          3D
2,3-Methyleneglutaric acid
 19 18  0  0  0  0  0  0  0  0999 V2000
    0.4121    1.4169    1.4079 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3448    0.7270    0.3148 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6284    0.4292   -0.3697 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9761   -1.0068   -0.3692 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9887   -1.3886   -0.9882 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1925   -1.8949    0.3041 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8963    0.2534   -0.2407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8124   -0.4419   -1.4015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2221    0.4577    0.3368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4143    1.0689    1.3799 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3162   -0.0666   -0.3298 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3818    1.7685    1.8140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4433    1.6868    1.9766 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5409    0.8210   -1.4077 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4996    0.9369    0.1405 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4632   -2.4248    1.1253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7378   -0.7979   -1.8171 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1448   -0.5832   -1.8335 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7305   -0.9617   -0.0426 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  2  7  1  0
  7  8  2  3
  7  9  1  0
  9 10  2  0
  9 11  1  0
  1 12  1  0
  1 13  1  0
  3 14  1  0
  3 15  1  0
  6 16  1  0
  8 17  1  0
  8 18  1  0
 11 19  1  0
M  END