HMDB0004226
     RDKit          3D
N4-Acetylaminobutanal
 20 19  0  0  0  0  0  0  0  0999 V2000
    3.4188    0.5187   -0.5044 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0558    0.2580    0.0191 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6355    0.9647    0.9592 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2721   -0.7702   -0.5486 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0571   -1.0350   -0.0498 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9917    0.1600   -0.1803 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3314   -0.2690    0.3768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3339    0.8291    0.3007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4494    0.5802    0.7267 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9493    1.2776    0.1054 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3074    0.8721   -1.5463 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0173   -0.4107   -0.4391 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6737   -1.3274   -1.3292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4691   -1.9153   -0.5796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0191   -1.3214    1.0260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6283    1.0085    0.4284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0252    0.4761   -1.2225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1597   -0.5881    1.4248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7101   -1.1087   -0.2350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1549    1.8007   -0.0911 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  4 13  1  0
  5 14  1  0
  5 15  1  0
  6 16  1  0
  6 17  1  0
  7 18  1  0
  7 19  1  0
  8 20  1  0
M  END