HMDB0032950
     RDKit          3D
5,7-Dihydroxy-4H-1-benzopyran-4-one
 19 20  0  0  0  0  0  0  0  0999 V2000
    2.1972    1.8384   -0.2783 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8682    0.6402   -0.1604 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7717   -0.3970   -0.0945 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3545   -1.7043    0.0358 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0713   -1.9606    0.0979 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1738   -0.9942    0.0382 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1852   -1.2924    0.1064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1499   -0.3118    0.0475 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5090   -0.6332    0.1177 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7773    1.0098   -0.0828 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4422    1.3529   -0.1543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0340    2.6632   -0.2847 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5059    0.3384   -0.0918 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8323   -0.1976   -0.1447 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0787   -2.5332    0.0884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4841   -2.3214    0.2081 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9951   -0.6764    1.0099 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5646    1.7663   -0.1270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7122    3.4127   -0.3315 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  8 10  2  0
 10 11  1  0
 11 12  1  0
 11 13  2  0
 13  2  1  0
 13  6  1  0
  3 14  1  0
  4 15  1  0
  7 16  1  0
  9 17  1  0
 10 18  1  0
 12 19  1  0
M  END