HMDB0002641
     RDKit          3D
2-Hydroxycinnamic acid
 20 20  0  0  0  0  0  0  0  0999 V2000
    3.4913    0.6591   -1.8964 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3864    0.1673   -0.7501 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5029   -0.1531   -0.0232 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0191   -0.0559   -0.2075 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9653    0.2514   -0.9050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4205    0.0907   -0.5075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4021    0.4939   -1.4295 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7392    0.3849   -1.1533 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2018   -0.1261    0.0438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2628   -0.5272    0.9614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8959   -0.4106    0.6672 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0177   -0.8253    1.6168 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1539    0.5703    0.2593 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9161   -0.4780    0.7764 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1882    0.6827   -1.9124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1225    0.9043   -2.3892 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4699    0.7120   -1.9022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2632   -0.2034    0.2416 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5726   -0.9361    1.9183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2906   -1.2009    2.4962 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  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
  9 10  1  0
 10 11  2  0
 11 12  1  0
 11  6  1  0
  3 13  1  0
  4 14  1  0
  5 15  1  0
  7 16  1  0
  8 17  1  0
  9 18  1  0
 10 19  1  0
 12 20  1  0
M  END