KEGG:C12933 Rolitetracycline nitrate -ISIS- 03150515202D 91 94 0 0 0 0 0 0 0 0999 V2000 -4.3209 -14.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3209 -15.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6005 -15.6709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6005 -14.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8843 -14.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8878 -15.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -15.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1639 -14.0155 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4470 -14.4353 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4545 -15.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7414 -15.6802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7265 -14.0261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0176 -14.4482 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0295 -15.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6810 -15.6965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4035 -15.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4154 -14.4687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7048 -14.0430 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1167 -15.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -15.2917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -15.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -15.2917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.0278 -15.6261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 -15.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1655 -14.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3563 -14.4691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7167 -13.2140 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 1.4412 -12.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0041 -12.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -13.6166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4542 -13.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8417 -13.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5875 -13.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5985 -16.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1726 -16.5030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7477 -16.5093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6691 -16.5255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1175 -16.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1399 -14.0624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0375 -16.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5746 -15.1460 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8581 -15.5522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5711 -14.3150 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2835 -15.5556 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.5708 -14.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3209 -14.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3209 -15.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6005 -15.6709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6005 -14.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8843 -14.4292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8878 -15.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -15.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1639 -14.0155 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4470 -14.4353 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4545 -15.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7414 -15.6802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7265 -14.0261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0176 -14.4482 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0295 -15.2750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6810 -15.6965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4035 -15.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4154 -14.4687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7048 -14.0430 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1167 -15.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -15.2917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -15.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2667 -15.2917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.0278 -15.6261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 -15.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1655 -14.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3563 -14.4691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7167 -13.2140 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 1.4412 -12.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0041 -12.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -13.6166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4542 -13.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8417 -13.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5875 -13.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5985 -16.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1726 -16.5030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7477 -16.5093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6691 -16.5255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1175 -16.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1399 -14.0624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0375 -16.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5746 -15.1460 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8581 -15.5522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5711 -14.3150 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2835 -15.5556 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.5708 -14.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5708 -14.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 41 42 1 0 0 0 0 41 43 2 0 0 0 0 41 44 1 0 0 0 0 5 4 2 0 0 0 0 21 22 1 0 0 0 0 4 1 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 22 1 0 0 0 0 11 14 1 0 0 0 0 18 27 1 6 0 0 0 13 12 1 0 0 0 0 27 28 1 0 0 0 0 12 9 1 0 0 0 0 27 29 1 0 0 0 0 13 30 1 6 0 0 0 1 2 2 0 0 0 0 9 31 1 6 0 0 0 2 3 1 0 0 0 0 8 32 1 6 0 0 0 5 6 1 0 0 0 0 8 33 1 1 0 0 0 6 7 1 0 0 0 0 3 34 1 0 0 0 0 7 10 1 0 0 0 0 7 35 2 0 0 0 0 13 14 1 0 0 0 0 11 36 1 0 0 0 0 14 15 1 0 0 0 0 15 37 2 0 0 0 0 15 16 1 0 0 0 0 19 38 2 0 0 0 0 16 17 2 0 0 0 0 17 39 1 0 0 0 0 17 18 1 0 0 0 0 14 40 1 6 0 0 0 18 13 1 0 0 0 0 9 8 1 0 0 0 0 16 19 1 0 0 0 0 8 5 1 0 0 0 0 65 66 1 0 0 0 0 50 49 2 0 0 0 0 66 67 1 0 0 0 0 49 46 1 0 0 0 0 54 55 1 0 0 0 0 55 56 2 0 0 0 0 67 68 1 0 0 0 0 68 69 1 0 0 0 0 69 70 1 0 0 0 0 70 71 1 0 0 0 0 71 67 1 0 0 0 0 56 59 1 0 0 0 0 63 72 1 6 0 0 0 58 57 1 0 0 0 0 72 73 1 0 0 0 0 57 54 1 0 0 0 0 72 74 1 0 0 0 0 58 75 1 6 0 0 0 46 47 2 0 0 0 0 54 76 1 6 0 0 0 47 48 1 0 0 0 0 53 77 1 6 0 0 0 50 51 1 0 0 0 0 53 78 1 1 0 0 0 51 52 1 0 0 0 0 48 79 1 0 0 0 0 52 55 1 0 0 0 0 52 80 2 0 0 0 0 58 59 1 0 0 0 0 56 81 1 0 0 0 0 59 60 1 0 0 0 0 60 82 2 0 0 0 0 60 61 1 0 0 0 0 64 83 2 0 0 0 0 61 62 2 0 0 0 0 62 84 1 0 0 0 0 62 63 1 0 0 0 0 59 85 1 6 0 0 0 63 58 1 0 0 0 0 54 53 1 0 0 0 0 61 64 1 0 0 0 0 53 50 1 0 0 0 0 64 65 1 0 0 0 0 48 51 2 0 0 0 0 19 20 1 0 0 0 0 3 6 2 0 0 0 0 86 87 1 0 0 0 0 86 88 2 0 0 0 0 86 89 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 4 41 1 44 -1 86 1 89 -1 M STY 2 1 MUL 2 MUL M SLB 2 1 1 2 2 M SAL 1 3 45 90 91 M SPA 1 1 45 M SDI 1 4 10.6200 -15.5400 10.6200 -14.3200 M SDI 1 4 12.0500 -14.3200 12.0500 -15.5400 M SMT 1 3 M SAL 2 15 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 M SAL 2 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 M SAL 2 15 31 32 33 34 35 36 37 38 39 40 41 42 43 44 46 M SAL 2 15 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 M SAL 2 15 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 M SAL 2 13 77 78 79 80 81 82 83 84 85 86 87 88 89 M SPA 2 15 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 M SPA 2 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 M SPA 2 14 31 32 33 34 35 36 37 38 39 40 41 42 43 44 M SDI 2 4 -4.7700 -17.1800 -4.7700 -12.2500 M SDI 2 4 9.0100 -12.2500 9.0100 -17.1800 M SMT 2 2 M END