HMDB0252318 RDKit 3D Flosulide 37 39 0 0 0 0 0 0 0 0999 V2000 -1.6755 3.1090 -0.9149 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0231 2.8804 -0.2733 S 0 0 0 0 0 6 0 0 0 0 0 0 0.9350 2.6439 -1.3983 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3202 4.1277 0.5051 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0356 1.5401 0.7984 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7876 0.3603 0.5571 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 0.4610 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8598 -0.6411 -0.2312 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3803 -1.8827 0.0995 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1263 -1.9790 0.6475 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3165 -0.8943 0.8856 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9291 -1.0230 1.4354 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1275 -0.6794 0.8414 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -0.1692 -0.4242 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5335 0.1482 -0.9347 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6791 -0.0376 -0.1911 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9051 0.2695 -0.6836 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.5426 -0.5501 1.0817 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -0.8665 1.5895 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1833 -1.3661 2.8391 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4231 -2.8755 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2325 -4.0707 -0.4935 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6948 -2.0795 -0.2214 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2245 -0.7653 -0.8063 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8768 2.3957 -1.7208 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 4.1473 -1.3109 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3661 3.0566 -0.0638 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5422 1.6512 1.6785 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4315 1.4703 -0.2411 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7721 -2.9927 0.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3782 -0.0230 -1.0161 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6211 0.5483 -1.9327 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4439 -0.6897 1.6496 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 -2.5518 -0.8062 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9863 -1.8777 0.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1289 -0.8695 -1.9067 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 0.0752 -0.5204 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 2 0 2 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 16 18 1 0 18 19 2 0 19 20 1 0 9 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 11 6 1 0 19 13 1 0 24 8 1 0 1 25 1 0 1 26 1 0 1 27 1 0 5 28 1 0 7 29 1 0 10 30 1 0 14 31 1 0 15 32 1 0 18 33 1 0 23 34 1 0 23 35 1 0 24 36 1 0 24 37 1 0 M END