HMDB0259192
     RDKit          3D
Triethylamine N-oxide
 23 22  0  0  0  0  0  0  0  0999 V2000
    2.0332   -0.7850    0.1968 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1257   -0.4755   -0.9455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1917   -0.0764   -0.5807 N   0  0  0  0  0  4  0  0  0  0  0  0
   -0.7961    0.4105   -1.7139 O   0  0  0  0  0  1  0  0  0  0  0  0
   -1.0139   -1.2027   -0.1555 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2794   -0.7523    0.5027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2511    0.9106    0.4646 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5069    2.1650    0.1550 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6831   -1.6712   -0.0477 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5340   -1.0083    1.1442 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7555    0.0466    0.3840 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0539   -1.3808   -1.5818 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5987    0.3435   -1.5423 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3026   -1.8156   -1.0434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4676   -1.8422    0.5609 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1595   -0.3920    1.5317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8024   -0.0227   -0.1580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9443   -1.6627    0.5771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3317    1.2020    0.5644 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1028    0.4251    1.4017 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0120    2.1610   -0.8205 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2778    2.3472    0.9406 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1433    3.0760    0.1656 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
  3  5  1  0
  5  6  1  0
  3  7  1  0
  7  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
  6 16  1  0
  6 17  1  0
  6 18  1  0
  7 19  1  0
  7 20  1  0
  8 21  1  0
  8 22  1  0
  8 23  1  0
M  CHG  2   3   1   4  -1
M  END