HMDB0252469 RDKit 3D Fostamatinib 66 69 0 0 0 0 0 0 0 0999 V2000 8.2165 -1.2676 -2.4788 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4670 -0.2782 -1.5026 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3886 0.1613 -0.7352 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1271 -0.3274 -0.8992 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0268 0.1114 -0.1262 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7636 -0.4359 -0.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6122 -0.2647 0.3914 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6042 0.4819 1.5002 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5149 0.6717 2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3285 0.0711 1.8922 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7854 0.2617 2.6655 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3076 -0.7043 0.7532 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9168 -1.3154 0.3843 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9481 -0.6369 0.0036 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9098 0.7392 -0.0645 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 1.4078 -0.4768 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2178 0.7220 -0.8241 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1997 -0.6587 -0.7372 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0915 -1.2755 -0.3357 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4187 -1.3505 -1.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4098 -2.7760 -1.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7374 -3.3528 0.1728 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2358 -3.0891 0.8155 P 0 0 0 0 0 5 0 0 0 0 0 0 -8.3824 -3.5722 -0.0536 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4769 -1.4674 1.2045 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3124 -4.0033 2.2749 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5578 -0.6257 -1.4985 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5760 -1.2504 -1.8721 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6032 0.8452 -1.5068 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6104 1.3009 -0.4436 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0886 1.3727 -2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3387 1.3770 -1.2321 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4244 -0.8635 0.0267 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3482 1.0749 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6148 1.5909 0.9944 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8352 2.5580 1.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7566 3.0132 2.7388 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6486 1.1320 0.2193 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9187 1.6421 0.4034 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7846 1.0162 1.3277 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1809 -1.6442 -2.9048 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6182 -0.8418 -3.2925 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6795 -2.1304 -2.0398 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9494 -1.0828 -1.6482 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6646 -1.0530 -1.2311 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5273 1.2857 3.1636 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 1.3088 0.1922 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0753 2.4918 -0.5513 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -2.3261 -0.2756 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4714 -3.2538 -1.3783 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1792 -3.1439 -1.7721 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1402 -1.2214 2.0995 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1420 -4.9521 2.0473 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2182 1.1940 0.5701 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7979 2.3856 -0.6911 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5436 0.7377 -0.5515 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1716 1.6185 -2.7817 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9642 0.5720 -3.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5743 2.3096 -3.1383 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5742 1.4740 1.4321 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3169 2.1203 3.2545 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9256 3.4346 2.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0811 3.7600 3.4893 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5025 -0.0504 1.4653 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8430 1.0430 1.0256 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7227 1.5164 2.3281 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 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 2 3 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 23 26 1 0 20 27 1 0 27 28 2 0 27 29 1 0 29 30 1 0 29 31 1 0 29 32 1 0 12 33 2 0 5 34 2 0 34 35 1 0 35 36 1 0 36 37 1 0 35 38 2 0 38 39 1 0 39 40 1 0 38 3 1 0 33 7 1 0 19 14 1 0 32 17 1 0 1 41 1 0 1 42 1 0 1 43 1 0 4 44 1 0 6 45 1 0 9 46 1 0 15 47 1 0 16 48 1 0 19 49 1 0 21 50 1 0 21 51 1 0 25 52 1 0 26 53 1 0 30 54 1 0 30 55 1 0 30 56 1 0 31 57 1 0 31 58 1 0 31 59 1 0 34 60 1 0 37 61 1 0 37 62 1 0 37 63 1 0 40 64 1 0 40 65 1 0 40 66 1 0 M END