HMDB0033549
     RDKit          3D
(E)-4-Hexenal
 17 16  0  0  0  0  0  0  0  0999 V2000
   -1.9785    0.4006   -0.0613 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6512   -0.8342   -0.7914 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4397   -1.2437   -0.9900 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7928   -0.6433   -0.5770 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8856    0.5847    0.2175 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3422    0.9591    0.4280 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5698    1.9382    1.0582 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5770    0.5168    0.9369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8175    1.2656   -0.7479 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1176    0.4171    0.1038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5288   -1.4344   -1.1887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4079   -2.2217   -1.5796 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5131   -1.4175   -0.1176 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3797   -0.4392   -1.5581 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3592    1.4714   -0.0867 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5940    0.3372    1.2971 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0818    0.3434    0.0120 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  1  8  1  0
  1  9  1  0
  1 10  1  0
  2 11  1  0
  3 12  1  0
  4 13  1  0
  4 14  1  0
  5 15  1  0
  5 16  1  0
  6 17  1  0
M  END