HMDB0039447
     RDKit          3D
2-Methyl-4-oxopentanedioic acid
 19 18  0  0  0  0  0  0  0  0999 V2000
   -1.2908   -1.6718    0.0702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1292   -0.3670   -0.6200 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2618    0.0242   -0.9508 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1980    0.1600    0.1434 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8706   -0.0516    1.3227 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5678    0.5533   -0.1082 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9749    0.7876   -1.2957 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5133    0.7010    0.8921 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8359    0.6981    0.1297 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7658    1.4009   -0.3815 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5229    0.9992    1.4550 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1129   -2.4967   -0.6744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3607   -1.7724    0.3670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6774   -1.8087    0.9613 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6751   -0.4390   -1.6134 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2040    1.0089   -1.5062 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7368   -0.6577   -1.7171 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2333    1.0034    1.8259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1894    1.9282    1.7000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  2  0
  6  8  1  0
  2  9  1  0
  9 10  2  0
  9 11  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  3 16  1  0
  3 17  1  0
  8 18  1  0
 11 19  1  0
M  END