HMDB0001252
     RDKit          3D
Betaine aldehyde
 19 18  0  0  0  0  0  0  0  0999 V2000
   -1.3148   -0.8089   -0.6578 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2624   -0.0076   -0.0161 N   0  0  0  0  0  4  0  0  0  0  0  0
   -0.4218   -0.2105    1.4093 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5011    1.3587   -0.3926 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9904   -0.5008   -0.5215 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1612    0.1292    0.1400 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2658   -0.2338   -0.2307 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2783   -0.2931   -0.6358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3171   -1.8013   -0.1608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0218   -0.9408   -1.7260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4634    0.1199    1.6545 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2471    0.4073    2.0193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3265   -1.2849    1.6167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1159    1.4215   -1.3327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1426    1.8115    0.4021 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4114    1.9419   -0.5499 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0316   -1.6037   -0.3258 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9860   -0.3850   -1.6124 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0723    0.8803    0.9200 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  2  5  1  0
  5  6  1  0
  6  7  2  0
  1  8  1  0
  1  9  1  0
  1 10  1  0
  3 11  1  0
  3 12  1  0
  3 13  1  0
  4 14  1  0
  4 15  1  0
  4 16  1  0
  5 17  1  0
  5 18  1  0
  6 19  1  0
M  CHG  1   2   1
M  END