HMDB0060534 RDKit 3D Desmethylazelastine 48 51 0 0 0 0 0 0 0 0999 V2000 -1.8357 -1.9422 -0.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8684 -1.3980 -0.0686 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -2.1640 0.1655 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3275 -3.4926 -0.1887 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4548 -4.2468 0.0648 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5614 -3.6837 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4507 -2.3563 1.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3419 -1.5698 0.7892 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2682 -0.2520 1.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4018 0.4529 1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4249 0.9434 0.8168 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6814 0.4254 0.6661 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5996 0.9086 -0.2506 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2757 1.9595 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4467 2.5778 -2.2412 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.0233 2.5122 -0.9532 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1259 2.0197 -0.0385 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1019 0.4137 0.8715 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9346 -0.1034 0.2913 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1597 0.6179 0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2948 0.1674 0.8926 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5566 -0.1370 0.1385 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2107 1.1059 -0.4194 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1789 2.1311 -0.5246 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3701 1.8739 -1.7004 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5081 0.6541 -1.4478 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5306 -3.9278 -0.6712 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5398 -5.2918 -0.2023 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4522 -4.2478 0.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2814 -1.9010 1.5285 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8468 -0.0889 2.6269 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9681 1.3847 2.2404 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0057 -0.3874 1.2779 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5870 0.4510 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7426 3.3387 -1.5862 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1246 2.4409 0.0726 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9499 1.6869 0.3081 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0233 -0.7754 1.4516 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5476 0.9037 1.6847 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4426 -0.9434 -0.6056 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2788 -0.5459 0.9009 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6514 0.8681 -1.3997 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0401 1.4747 0.2287 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6745 3.0506 -0.6239 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7078 2.7594 -1.8464 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9915 1.7592 -2.6133 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5589 0.8263 -2.0088 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9763 -0.2525 -1.8375 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 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 14 16 1 0 16 17 2 0 9 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 19 2 1 0 26 20 1 0 8 3 1 0 17 11 1 0 4 27 1 0 5 28 1 0 6 29 1 0 7 30 1 0 10 31 1 0 10 32 1 0 12 33 1 0 13 34 1 0 16 35 1 0 17 36 1 0 20 37 1 0 21 38 1 0 21 39 1 0 22 40 1 0 22 41 1 0 23 42 1 0 23 43 1 0 24 44 1 0 25 45 1 0 25 46 1 0 26 47 1 0 26 48 1 0 M END