HMDB0246110 RDKit 3D 3',4'-Dihydroxyflurbiprofen 33 34 0 0 0 0 0 0 0 0999 V2000 4.1634 1.8024 0.1795 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7222 0.5188 -0.5112 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4749 -0.6267 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2731 -0.4475 0.9701 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2459 -1.8739 -0.5356 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2606 0.3080 -0.3699 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6597 0.1467 0.8534 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2771 -0.0512 0.9636 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5032 -0.0862 -0.1704 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9385 -0.2890 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5352 -1.1824 -0.9732 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8914 -1.4355 -0.9737 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6652 -0.7579 -0.0543 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0497 -0.9925 -0.0281 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 0.1450 0.8439 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9724 0.7794 1.7297 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 0.3545 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1206 0.0778 -1.3862 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5899 0.0536 -2.5396 F 0 0 0 0 0 0 0 0 0 0 0 0 1.4838 0.2732 -1.4998 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 1.7898 1.2206 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2856 1.7769 0.1634 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8359 2.6989 -0.3926 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9942 0.6237 -1.5634 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2666 -2.1444 -0.6597 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2924 0.1779 1.7308 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1287 -0.1702 1.9477 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9281 -1.7188 -1.6999 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3535 -2.1330 -1.6578 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6397 -0.5170 0.6268 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7089 1.4440 2.4183 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3271 1.0557 1.4873 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9546 0.4001 -2.4667 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 3 5 1 0 2 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 2 0 13 14 1 0 13 15 1 0 15 16 1 0 15 17 2 0 9 18 1 0 18 19 1 0 18 20 2 0 20 6 1 0 17 10 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 5 25 1 0 7 26 1 0 8 27 1 0 11 28 1 0 12 29 1 0 14 30 1 0 16 31 1 0 17 32 1 0 20 33 1 0 M END