HMDB0246304
     RDKit          3D
4-(Dimethylamino)benzoic acid
 23 23  0  0  0  0  0  0  0  0999 V2000
   -2.7468   -1.0381   -0.9693 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9702   -0.1607   -0.1414 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6439    0.7576    0.7726 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5481   -0.1002   -0.1485 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1431   -0.0625    1.0723 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5137    0.0163    1.1346 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2387    0.0617   -0.0618 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6878    0.1643   -0.0530 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3006    0.1906   -1.1357 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3841    0.2304    1.1410 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5743    0.0263   -1.2612 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2055   -0.0526   -1.3037 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1959   -1.5450   -1.7590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6221   -0.5029   -1.4511 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2559   -1.8305   -0.3430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5862    0.4315    1.8308 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7114    0.9063    0.5268 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1673    1.7858    0.6568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4251   -0.0905    1.9908 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0827    0.0400    2.0458 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9525    0.7867    1.8823 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1391    0.0627   -2.1840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3495   -0.0771   -2.2420 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
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
  7 11  1  0
 11 12  2  0
 12  4  1  0
  1 13  1  0
  1 14  1  0
  1 15  1  0
  3 16  1  0
  3 17  1  0
  3 18  1  0
  5 19  1  0
  6 20  1  0
 10 21  1  0
 11 22  1  0
 12 23  1  0
M  END