HMDB0254590
     RDKit          3D
Methyl gallate
 21 21  0  0  0  0  0  0  0  0999 V2000
    3.8929    1.0716   -0.0014 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4781    1.0236   -0.0714 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7659   -0.1579   -0.0603 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4035   -1.2353    0.0153 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3045   -0.1804   -0.1336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4136    0.9892   -0.2169 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7861    0.9444   -0.2849 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5425    2.1265   -0.3706 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4769   -0.2460   -0.2724 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8679   -0.2420   -0.3433 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7333   -1.3940   -0.1887 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4172   -2.6149   -0.1746 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3567   -1.3846   -0.1191 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3725    0.7450   -0.9389 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1725    2.1173    0.2225 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2737    0.3782    0.7939 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1226    1.9567   -0.2284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0912    3.0397   -0.3842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3724   -1.1211   -0.3338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9217   -3.4782   -0.1149 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1931   -2.3378   -0.0530 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  7  9  2  0
  9 10  1  0
  9 11  1  0
 11 12  1  0
 11 13  2  0
 13  5  1  0
  1 14  1  0
  1 15  1  0
  1 16  1  0
  6 17  1  0
  8 18  1  0
 10 19  1  0
 12 20  1  0
 13 21  1  0
M  END