HMDB0245963
     RDKit          3D
3-Oxopentanoic acid
 16 15  0  0  0  0  0  0  0  0999 V2000
    2.3829    0.3405   -0.2920 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0846   -0.0217    0.3643 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0810   -0.5142   -0.6333 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3322   -0.5996   -1.8289 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2739   -0.9178   -0.1730 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2494    0.1976   -0.4418 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4472   -0.0085   -0.0961 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8798    1.3781   -1.0272 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9962    0.8852    0.4621 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9209   -0.5733   -0.6313 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2647    0.9820   -1.1823 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6810    0.8363    0.9403 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2839   -0.8756    1.0484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6507   -1.8314   -0.7159 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2540   -1.0876    0.9253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2724    1.8100   -1.8317 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  1  0
  6  7  2  0
  6  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  5 14  1  0
  5 15  1  0
  8 16  1  0
M  END