HMDB0032495
     RDKit          3D
Propyl 2-mercaptopropionate
 21 20  0  0  0  0  0  0  0  0999 V2000
   -3.5234   -0.0781    0.4889 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0228    0.0468    0.7884 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4167    0.6835   -0.4523 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0207    0.8670   -0.3253 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8986   -0.1504   -0.1232 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4442   -1.3231   -0.0492 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3656    0.1319    0.0016 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1090   -1.1513    0.2130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6449    1.3350    1.3173 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9444    0.9452    0.5554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5852   -0.3845   -0.5738 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0014   -0.7985    1.1773 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6389   -0.9815    0.9318 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8380    0.6500    1.6887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8552    1.6776   -0.6545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6783    0.0465   -1.3215 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7576    0.5898   -0.9483 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3592   -1.3476    1.2712 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4632   -1.9788   -0.1445 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0306   -1.1998   -0.4381 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4522    2.4200    0.8707 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  7  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  2 14  1  0
  3 15  1  0
  3 16  1  0
  7 17  1  0
  8 18  1  0
  8 19  1  0
  8 20  1  0
  9 21  1  0
M  END