56842117 -OEChem-05102418272D 150158 0 1 0 0 0 0 0999 V2000 18.0852 2.6200 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 19.1306 12.1387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7095 11.4268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.2848 21.3324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1788 19.7584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6708 19.7631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.0548 21.3082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8116 10.8906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 10.4252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 9.4252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 10.4252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 11.9252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 7.4252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 7.4252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5493 0.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0852 0.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0704 7.6805 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.3035 10.4153 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.5368 18.2631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.8144 15.9625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0632 11.9252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0632 13.9252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 12.4252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8232 13.9599 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7292 12.4044 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5933 13.9494 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 10.9252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.8173 0.6200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.6833 2.1200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.4814 8.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8974 9.4039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4764 8.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0754 7.5807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6543 6.8687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3085 10.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8875 9.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6643 6.6690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2433 5.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2483 5.8573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7145 11.3270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2049 16.6882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7998 17.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4028 17.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1936 16.7913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5416 13.0504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2689 19.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7684 15.7493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1789 19.7700 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 19.3698 14.9064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4028 19.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2689 18.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5368 19.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9152 13.9283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3997 15.0137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7727 15.6571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6688 18.8982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3868 20.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6144 13.1622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0463 14.1505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1869 20.8116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3546 14.7487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1588 18.0380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 12.4252 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1972 13.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 11.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 12.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 13.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8232 11.8905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0632 10.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 11.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7292 13.4460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 12.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 10.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 11.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 10.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 10.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 10.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 10.4252 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2690 9.4252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 8.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 10.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 7.9252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9512 2.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6833 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9512 1.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8173 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8435 8.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3851 9.7530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4647 8.9599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4302 8.0737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0773 8.5391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1215 8.1989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4745 7.7335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1667 6.5196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0871 7.3127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3547 10.9338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7076 10.4683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3998 9.2544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3202 10.0475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1520 7.0182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2315 6.2251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1971 5.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8441 5.8043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6897 5.5881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4164 5.2605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4344 18.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2633 17.2853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8058 17.9531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2978 13.8712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8236 16.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1730 15.8146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1391 18.4942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1483 19.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1688 21.3850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7776 20.6891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9803 12.6617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6622 14.2219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.6255 18.3542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8427 17.5047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.6922 17.7218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7914 15.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0954 14.1855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9178 14.4895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.4826 19.2179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 11.8052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9851 14.0078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5866 13.3175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9326 11.4503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7297 11.4503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0632 14.5452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 13.0452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8160 14.5798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6002 10.6152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 13.0452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1360 10.6152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1315 13.6414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5910 14.5693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 12.2352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 9.8052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 11.0452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 11.5452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 8.8426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8796 9.5329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1909 9.5078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7924 8.8175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 10.7352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 6.8052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8173 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2202 2.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8173 3.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 83 1 0 0 0 0 2 40 1 0 0 0 0 2 45 1 0 0 0 0 3 40 2 0 0 0 0 4 57 1 0 0 0 0 4 60 1 0 0 0 0 48 5 1 1 0 0 0 5124 1 0 0 0 0 6 52 2 0 0 0 0 7 60 2 0 0 0 0 8 68 2 0 0 0 0 9 69 2 0 0 0 0 10 77 2 0 0 0 0 11 81 1 0 0 0 0 11146 1 0 0 0 0 12 81 2 0 0 0 0 13 82 1 0 0 0 0 13147 1 0 0 0 0 14 82 2 0 0 0 0 15 84 2 0 0 0 0 16 85 2 0 0 0 0 17 30 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 40 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 52 1 0 0 0 0 20 44 2 0 0 0 0 20 54 1 0 0 0 0 21 63 1 0 0 0 0 21 66 1 0 0 0 0 21 69 1 0 0 0 0 22 64 1 0 0 0 0 22 67 1 0 0 0 0 22130 1 0 0 0 0 23 65 1 0 0 0 0 23 70 1 0 0 0 0 23131 1 0 0 0 0 24 67 1 0 0 0 0 24 71 1 0 0 0 0 24132 1 0 0 0 0 25 68 1 0 0 0 0 25 71 2 0 0 0 0 26 71 1 0 0 0 0 26136 1 0 0 0 0 26137 1 0 0 0 0 27 77 1 0 0 0 0 78 27 1 1 0 0 0 27141 1 0 0 0 0 28 84 1 0 0 0 0 28 85 1 0 0 0 0 28148 1 0 0 0 0 29 84 1 0 0 0 0 29 86 1 0 0 0 0 29149 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 87 1 0 0 0 0 31 35 1 0 0 0 0 31 88 1 0 0 0 0 31 89 1 0 0 0 0 32 36 1 0 0 0 0 32 90 1 0 0 0 0 32 91 1 0 0 0 0 33 37 1 0 0 0 0 33 92 1 0 0 0 0 33 93 1 0 0 0 0 34 38 1 0 0 0 0 34 94 1 0 0 0 0 34 95 1 0 0 0 0 35 96 1 0 0 0 0 35 97 1 0 0 0 0 36 98 1 0 0 0 0 36 99 1 0 0 0 0 37 39 1 0 0 0 0 37100 1 0 0 0 0 37101 1 0 0 0 0 38 39 1 0 0 0 0 38102 1 0 0 0 0 38103 1 0 0 0 0 39104 1 0 0 0 0 39105 1 0 0 0 0 41 42 1 0 0 0 0 41 44 1 0 0 0 0 41 47 2 0 0 0 0 42106 1 0 0 0 0 42107 1 0 0 0 0 43 44 1 0 0 0 0 43 51 2 0 0 0 0 45 53 2 0 0 0 0 45 58 1 0 0 0 0 46 48 1 0 0 0 0 46 50 2 0 0 0 0 46 51 1 0 0 0 0 47 49 1 0 0 0 0 47 55 1 0 0 0 0 48 56 1 0 0 0 0 48 60 1 0 0 0 0 49 53 1 0 0 0 0 49 54 2 0 0 0 0 50 52 1 0 0 0 0 50 57 1 0 0 0 0 51108 1 0 0 0 0 53109 1 0 0 0 0 54 59 1 0 0 0 0 55 61 1 0 0 0 0 55110 1 0 0 0 0 55111 1 0 0 0 0 56 62 1 0 0 0 0 56112 1 0 0 0 0 56113 1 0 0 0 0 57114 1 0 0 0 0 57115 1 0 0 0 0 58 59 2 0 0 0 0 58116 1 0 0 0 0 59117 1 0 0 0 0 61121 1 0 0 0 0 61122 1 0 0 0 0 61123 1 0 0 0 0 62118 1 0 0 0 0 62119 1 0 0 0 0 62120 1 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 63125 1 0 0 0 0 64126 1 0 0 0 0 64127 1 0 0 0 0 65128 1 0 0 0 0 65129 1 0 0 0 0 66 67 2 0 0 0 0 66 68 1 0 0 0 0 69133 1 0 0 0 0 70 72 2 0 0 0 0 70 73 1 0 0 0 0 72 74 1 0 0 0 0 72134 1 0 0 0 0 73 75 2 0 0 0 0 73135 1 0 0 0 0 74 76 2 0 0 0 0 74138 1 0 0 0 0 75 76 1 0 0 0 0 75139 1 0 0 0 0 76 77 1 0 0 0 0 78 79 1 0 0 0 0 78 81 1 0 0 0 0 78140 1 0 0 0 0 79 80 1 0 0 0 0 79142 1 0 0 0 0 79143 1 0 0 0 0 80 82 1 0 0 0 0 80144 1 0 0 0 0 80145 1 0 0 0 0 83 85 1 0 0 0 0 83 86 2 0 0 0 0 86150 1 0 0 0 0 M END > 56842117 > 1 > 2310 > 20 > 10 > 14 > AAADcfB//QAAAAAAAAAAAAAAAAAAAWAAAAA8eLECAAAAAFix9AAAHwAQCAAADGzhngYzzvPIFgCoAyX2/AKCiCElIiAJmKH+bNiPZvbE9buecyhu9zPb+ce87/CeiEABAAACAAAQgAIAAAQAAAAAAAAAAA== > (2S)-2-[[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid;[(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-(1-piperidyl)piperidine-1-carboxylate;5-fluoro-1H-pyrimidine-2,4-dione > (2S)-2-[[[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]phenyl]-oxomethyl]amino]pentanedioic acid;5-fluoro-1H-pyrimidine-2,4-dione;4-(1-piperidinyl)-1-piperidinecarboxylic acid [(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]heneicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] ester > (2S)-2-[[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid;[(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;5-fluoro-1H-pyrimidine-2,4-dione > (2S)-2-[[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid;[(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;5-fluoro-1H-pyrimidine-2,4-dione > (2S)-2-[[4-[(2-azanyl-5-methanoyl-4-oxidanylidene-1,6,7,8-tetrahydropteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioic acid;[(19S)-10,19-diethyl-19-oxidanyl-14,18-bis(oxidanylidene)-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;5-fluoranyl-1H-pyrimidine-2,4-dione > (2S)-2-[[4-[(2-amino-5-formyl-4-keto-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]glutaric acid;5-fluorouracil;4-piperidinopiperidine-1-carboxylic acid [(19S)-10,19-diethyl-19-hydroxy-14,18-diketo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]heneicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] ester > InChI=1S/C33H38N4O6.C20H23N7O7.C4H3FN2O2/c1-3-22-23-16-21(43-32(40)36-14-10-20(11-15-36)35-12-6-5-7-13-35)8-9-27(23)34-29-24(22)18-37-28(29)17-26-25(30(37)38)19-42-31(39)33(26,41)4-2;21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30;5-2-1-6-4(9)7-3(2)8/h8-9,16-17,20,41H,3-7,10-15,18-19H2,1-2H3;1-4,9,12-13,22H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,23,25,26,32);1H,(H2,6,7,8,9)/t33-;12?,13-;/m00./s1 > JYEFSHLLTQIXIO-SMNQTINBSA-N > 1189.46288655 > C57H64FN13O15 > 1190.2 > CCC1=C2CN3C(=CC4=C(C3=O)COC(=O)C4(CC)O)C2=NC5=C1C=C(C=C5)OC(=O)N6CCC(CC6)N7CCCCC7.C1C(N(C2=C(N1)NC(=NC2=O)N)C=O)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O.C1=C(C(=O)NC(=O)N1)F > CCC1=C2CN3C(=CC4=C(C3=O)COC(=O)[C@@]4(CC)O)C2=NC5=C1C=C(C=C5)OC(=O)N6CCC(CC6)N7CCCCC7.C1C(N(C2=C(N1)NC(=NC2=O)N)C=O)CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O.C1=C(C(=O)NC(=O)N1)F > 386 > 1189.46288655 > 0 > 86 > 2 > 1 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 19 43 8 19 52 8 20 44 8 20 54 8 24 67 8 24 71 8 25 68 8 25 71 8 78 27 5 28 84 8 28 85 8 29 84 8 29 86 8 41 44 8 41 47 8 43 51 8 45 53 8 45 58 8 46 50 8 46 51 8 47 49 8 49 53 8 49 54 8 48 5 5 50 52 8 54 59 8 58 59 8 63 65 3 66 67 8 66 68 8 70 72 8 70 73 8 72 74 8 73 75 8 74 76 8 75 76 8 83 85 8 83 86 8 $$$$