HMDB0302434
     RDKit          3D
Phenols
 23 25  0  0  0  0  0  0  0  0999 V2000
   -3.6167    0.7496    0.2339 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7812   -0.6074    0.1654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6842   -1.4171    0.0615 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4482   -0.8748    0.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2320    0.4753    0.0923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3579    1.2916    0.1982 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0188    1.0975    0.0616 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2595    0.4555   -0.0404 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4345    1.2137   -0.0594 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6485    0.6004   -0.1584 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7697   -0.7668   -0.2425 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6002   -1.4904   -0.2218 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3911   -0.8946   -0.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0488   -1.9727   -0.1093 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5084    1.3884    0.3173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8063   -0.9992    0.1973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8360   -2.4805    0.0091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2802    2.3754    0.2557 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0606    2.1647    0.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3937    2.2900    0.0039 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5735    1.2082   -0.1727 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7443   -1.2348   -0.3206 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7052   -2.5722   -0.2888 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  2  0
  5  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
  6  1  1  0
 13  8  1  0
 14  4  1  0
  1 15  1  0
  2 16  1  0
  3 17  1  0
  6 18  1  0
  7 19  1  0
  9 20  1  0
 10 21  1  0
 11 22  1  0
 12 23  1  0
M  END