KEGG:C13254 Mebhydrolin napadisilate ISISHOST01200522392D 1 1.00000 0.00000 16431 60 67 0 0 0 999 V2000 -4.2458 0.8917 0.0000 C 0 0 0 0 0 0 0 0 0 -4.2458 0.0667 0.0000 C 0 0 0 0 0 0 0 0 0 -3.5296 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 -3.5296 1.3042 0.0000 C 0 0 0 0 0 0 0 0 0 -2.8176 0.8917 0.0000 C 0 0 0 0 0 0 0 0 0 -2.8211 0.0647 0.0000 C 0 0 0 0 0 0 0 0 0 -2.0356 -0.1942 0.0000 N 0 0 3 0 0 0 0 0 0 -2.0301 1.1439 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5510 0.4727 0.0000 C 0 0 0 0 0 0 0 0 0 -0.7303 0.5520 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3885 1.3024 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8675 1.9736 0.0000 N 0 0 3 0 0 0 0 0 0 -1.6883 1.8944 0.0000 C 0 0 0 0 0 0 0 0 0 -1.7823 -0.9794 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9757 -1.1526 0.0000 C 0 0 0 0 0 0 0 0 0 -0.7269 -1.9362 0.0000 C 0 0 0 0 0 0 0 0 0 0.0797 -2.1094 0.0000 C 0 0 0 0 0 0 0 0 0 0.6330 -1.4975 0.0000 C 0 0 0 0 0 0 0 0 0 0.3797 -0.7123 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4269 -0.5391 0.0000 C 0 0 0 0 0 0 0 0 0 -0.5256 2.7244 0.0000 C 0 0 0 0 0 0 0 0 0 5.0786 -0.1754 0.0000 C 0 0 0 0 0 0 0 0 0 4.3634 0.2350 0.0000 C 0 0 0 0 0 0 0 0 0 5.7870 0.2461 0.0000 C 0 0 0 0 0 0 0 0 0 5.0862 -1.0033 0.0000 C 0 0 0 0 0 0 0 0 0 4.3599 1.0671 0.0000 C 0 0 0 0 0 0 0 0 0 3.6516 -0.1789 0.0000 C 0 0 0 0 0 0 0 0 0 5.7870 1.0706 0.0000 C 0 0 0 0 0 0 0 0 0 4.3745 -1.4138 0.0000 C 0 0 0 0 0 0 0 0 0 5.7904 -1.4138 0.0000 S 0 0 3 0 0 0 0 0 0 5.0717 1.4845 0.0000 C 0 0 0 0 0 0 0 0 0 3.6405 1.4810 0.0000 S 0 0 3 0 0 0 0 0 0 3.6551 -1.0033 0.0000 C 0 0 0 0 0 0 0 0 0 6.5098 -1.8277 0.0000 O 0 0 0 0 0 0 0 0 0 5.3764 -2.1255 0.0000 O 0 0 0 0 0 0 0 0 0 6.2085 -0.6944 0.0000 O 0 0 0 0 0 0 0 0 0 2.9219 1.8949 0.0000 O 0 0 0 0 0 0 0 0 0 4.0475 2.1997 0.0000 O 0 0 0 0 0 0 0 0 0 3.2208 0.7708 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2458 0.8917 0.0000 C 0 0 0 0 0 0 0 0 0 -4.2458 0.0667 0.0000 C 0 0 0 0 0 0 0 0 0 -3.5296 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 -3.5296 1.3042 0.0000 C 0 0 0 0 0 0 0 0 0 -2.8176 0.8917 0.0000 C 0 0 0 0 0 0 0 0 0 -2.8211 0.0647 0.0000 C 0 0 0 0 0 0 0 0 0 -2.0356 -0.1942 0.0000 N 0 0 3 0 0 0 0 0 0 -2.0301 1.1439 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5510 0.4727 0.0000 C 0 0 0 0 0 0 0 0 0 -0.7303 0.5520 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3885 1.3024 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8675 1.9736 0.0000 N 0 0 3 0 0 0 0 0 0 -1.6883 1.8944 0.0000 C 0 0 0 0 0 0 0 0 0 -1.7823 -0.9794 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9757 -1.1526 0.0000 C 0 0 0 0 0 0 0 0 0 -0.7269 -1.9362 0.0000 C 0 0 0 0 0 0 0 0 0 0.0797 -2.1094 0.0000 C 0 0 0 0 0 0 0 0 0 0.6330 -1.4975 0.0000 C 0 0 0 0 0 0 0 0 0 0.3797 -0.7123 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4269 -0.5391 0.0000 C 0 0 0 0 0 0 0 0 0 -0.5256 2.7244 0.0000 C 0 0 0 0 0 0 0 0 0 14 15 1 0 0 0 5 6 1 0 0 0 6 7 1 0 0 0 22 23 2 0 0 0 22 24 1 0 0 0 22 25 1 0 0 0 23 26 1 0 0 0 23 27 1 0 0 0 24 28 2 0 0 0 25 29 2 0 0 0 25 30 1 0 0 0 26 31 2 0 0 0 26 32 1 0 0 0 27 33 2 0 0 0 30 34 1 0 0 0 30 35 2 0 0 0 30 36 2 0 0 0 32 37 1 0 0 0 32 38 2 0 0 0 28 31 1 0 0 0 29 33 1 0 0 0 7 9 1 0 0 0 32 39 2 0 0 0 8 5 1 0 0 0 15 16 2 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 20 15 1 0 0 0 3 6 2 0 0 0 12 21 1 0 0 0 5 4 2 0 0 0 4 1 1 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 46 48 1 0 0 0 47 44 1 0 0 0 42 45 2 0 0 0 44 43 2 0 0 0 43 40 1 0 0 0 40 41 2 0 0 0 41 42 1 0 0 0 47 48 2 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 47 1 0 0 0 8 9 2 0 0 0 46 53 1 0 0 0 9 10 1 0 0 0 53 54 1 0 0 0 10 11 1 0 0 0 11 12 1 0 0 0 12 13 1 0 0 0 13 8 1 0 0 0 54 55 2 0 0 0 55 56 1 0 0 0 56 57 2 0 0 0 57 58 1 0 0 0 58 59 2 0 0 0 59 54 1 0 0 0 7 14 1 0 0 0 51 60 1 0 0 0 M STY 1 1 MUL M SLB 1 1 1 M SCN 1 1 HT M SAL 1 15 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 M SAL 1 15 16 17 18 19 20 21 40 41 42 43 44 45 46 47 48 M SAL 1 12 49 50 51 52 53 54 55 56 57 58 59 60 M SPA 1 15 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 M SPA 1 6 16 17 18 19 20 21 M SMT 1 2 M SDI 1 4 -4.6900 -2.5500 -4.6900 3.1700 M SDI 1 4 1.0700 3.1700 1.0700 -2.5500 M END