HMDB0242143
     RDKit          3D
3-Indoleglyoxylic acid
 21 22  0  0  0  0  0  0  0  0999 V2000
    2.1649    1.5291    0.8880 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7713    0.4729    0.6709 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0809    0.4037    1.1977 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2097   -0.6166   -0.0587 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9985   -1.6084   -0.2958 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8496   -0.6533   -0.5322 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4668   -1.1006   -1.8186 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8462   -0.9372   -1.9644 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3952   -0.4003   -0.8440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6972   -0.0711   -0.5236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9541    0.4465    0.7260 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9020    0.6209    1.6237 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6060    0.2846    1.2805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3221   -0.2291    0.0447 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8631    0.2248    0.5934 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1689   -1.5041   -2.5349 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4571   -1.1655   -2.7996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4862   -0.2198   -1.2423 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9639    0.7066    0.9853 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1299    1.0284    2.5997 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1860    0.4018    2.0041 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
  4  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14  6  1  0
 14  9  1  0
  3 15  1  0
  7 16  1  0
  8 17  1  0
 10 18  1  0
 11 19  1  0
 12 20  1  0
 13 21  1  0
M  END