HMDB0037619
     RDKit          3D
Methyl 4-(methylthio)butyrate
 21 20  0  0  0  0  0  0  0  0999 V2000
    4.0389   -0.1422   -0.1846 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9320   -0.5853    0.5375 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6867    0.0380    0.3443 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6840    0.9695   -0.4898 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4903   -0.4063    1.0936 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7568    0.3023    0.6572 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0525   -0.0029   -0.7685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5561    0.8168   -1.3592 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0383    0.1791   -0.5282 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2416    0.9379    0.0164 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9216   -0.2239   -1.2835 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9044   -0.7852    0.0919 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4313   -1.5120    0.8979 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6447   -0.3443    2.1939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5671   -0.0315    1.3515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6758    1.4015    0.8536 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1464   -1.1241   -0.8446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2314    0.3306   -1.4132 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8184   -0.8751   -0.2501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2150    0.8147    0.3733 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9176    0.2422   -1.1955 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
  7  8  1  0
  8  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  5 13  1  0
  5 14  1  0
  6 15  1  0
  6 16  1  0
  7 17  1  0
  7 18  1  0
  9 19  1  0
  9 20  1  0
  9 21  1  0
M  END