44242782 -OEChem-04242420532D 163172 0 1 0 0 0 0 0999 V2000 13.4047 6.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7097 10.5002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6727 6.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4124 16.8819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9259 15.9928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4047 4.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9247 9.6985 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.6727 3.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9406 4.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5285 6.1671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5387 2.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0746 5.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9406 7.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1368 3.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1368 1.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4047 0.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6727 0.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8067 1.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0529 9.2085 0.0000 N 0 3 3 0 0 0 0 0 0 0 0 0 2.4109 7.7017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3058 11.0102 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.4297 9.4653 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.4417 10.5069 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.3019 12.0102 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.3297 8.9410 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.2177 10.5069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3423 7.8561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2298 9.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4340 12.5069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4139 13.5483 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.3099 14.0795 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.2100 12.5206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4797 8.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2140 13.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4047 7.3100 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5738 11.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2899 11.1877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4672 7.8561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5656 9.9687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2874 11.8404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5699 12.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4600 14.0653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3141 15.1645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4391 15.1501 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.3422 7.8638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8489 6.9940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3724 15.7034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1701 14.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4392 15.1346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9258 16.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5387 5.8100 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1429 8.7017 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2769 9.2017 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1429 7.7017 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5387 4.8100 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4109 8.7017 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2608 10.2432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2769 7.2017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 10.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0011 7.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8922 8.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1589 10.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6727 4.3100 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8666 7.6889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5169 9.2363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8067 5.8100 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8067 4.8100 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6109 8.7225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5169 7.1670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6109 7.6809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4047 3.3100 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.9406 6.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2708 2.8100 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.2708 1.8100 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.5387 1.8100 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4047 1.3100 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.6727 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1762 10.0791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0691 8.5217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8298 10.4079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4200 11.0930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4456 8.8841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8394 9.5785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6878 13.1064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4168 11.9361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8212 12.6243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2775 9.5271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8677 8.8420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8244 13.4537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4253 14.1451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9423 7.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3999 10.5775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9001 11.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1799 11.7978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8576 7.9693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2514 7.2749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8776 10.5044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0298 10.2807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2535 9.4329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1821 11.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8984 11.7351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3927 12.4514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0318 12.3115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8472 14.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2622 13.4776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9245 15.0561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5254 15.7474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3470 7.2438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9622 7.8686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3375 8.4838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3144 6.6798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1631 6.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3835 7.3081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7679 16.1809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9696 16.1747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4863 14.0562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7034 14.9057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8539 15.1228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4296 15.7546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8193 15.1251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4488 14.5147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5387 6.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1429 9.5517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5375 9.6210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1424 6.8517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0756 5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4174 9.5516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0428 10.8236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6517 10.1277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8784 6.7267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6754 6.7267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 10.1393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2745 10.8322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6001 6.7319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3952 6.7261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4993 8.5544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 9.2554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0941 17.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5562 11.2469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7579 11.2438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0684 7.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4794 7.7833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2096 4.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9215 9.7061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1233 9.7154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8067 6.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2697 5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4018 9.3062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.6164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 7.7870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4018 7.0972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9417 3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1357 3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9406 3.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8077 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2708 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5377 6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0018 2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8678 1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1368 3.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6737 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9417 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2096 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 35 1 1 1 0 0 0 51 1 1 6 0 0 0 2 36 2 0 0 0 0 3 51 1 0 0 0 0 3 66 1 0 0 0 0 4 50 1 0 0 0 0 4138 1 0 0 0 0 5 50 2 0 0 0 0 55 6 1 6 0 0 0 71 6 1 1 0 0 0 7 19 1 0 0 0 0 63 8 1 1 0 0 0 8153 1 0 0 0 0 67 9 1 6 0 0 0 9154 1 0 0 0 0 10 69 2 0 0 0 0 11 71 1 0 0 0 0 11 75 1 0 0 0 0 12 72 1 0 0 0 0 12157 1 0 0 0 0 13 72 2 0 0 0 0 73 14 1 6 0 0 0 14160 1 0 0 0 0 74 15 1 1 0 0 0 15161 1 0 0 0 0 76 16 1 6 0 0 0 16162 1 0 0 0 0 17 77 1 0 0 0 0 17163 1 0 0 0 0 18 77 2 0 0 0 0 19 52 1 0 0 0 0 19 59 1 0 0 0 0 19 61 1 0 0 0 0 20 56 1 0 0 0 0 20 58 1 0 0 0 0 20 69 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 21 26 1 0 0 0 0 21 37 1 1 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 33 1 0 0 0 0 22 39 1 1 0 0 0 23 36 1 0 0 0 0 23 78 1 6 0 0 0 24 29 1 0 0 0 0 24 32 1 0 0 0 0 24 40 1 6 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 25 79 1 6 0 0 0 26 28 1 0 0 0 0 26 80 1 0 0 0 0 26 81 1 0 0 0 0 27 35 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 82 1 0 0 0 0 28 83 1 0 0 0 0 29 30 1 0 0 0 0 29 41 2 0 0 0 0 30 31 1 0 0 0 0 30 42 1 0 0 0 0 30 84 1 1 0 0 0 31 34 1 0 0 0 0 31 43 1 0 0 0 0 31 48 1 1 0 0 0 32 34 1 0 0 0 0 32 85 1 0 0 0 0 32 86 1 0 0 0 0 33 38 1 0 0 0 0 33 87 1 0 0 0 0 33 88 1 0 0 0 0 34 89 1 0 0 0 0 34 90 1 0 0 0 0 35 38 1 0 0 0 0 35 91 1 0 0 0 0 36 41 1 0 0 0 0 37 92 1 0 0 0 0 37 93 1 0 0 0 0 37 94 1 0 0 0 0 38 95 1 0 0 0 0 38 96 1 0 0 0 0 39 97 1 0 0 0 0 39 98 1 0 0 0 0 39 99 1 0 0 0 0 40100 1 0 0 0 0 40101 1 0 0 0 0 40102 1 0 0 0 0 41103 1 0 0 0 0 42 44 1 0 0 0 0 42104 1 0 0 0 0 42105 1 0 0 0 0 43 47 1 0 0 0 0 43106 1 0 0 0 0 43107 1 0 0 0 0 44 47 1 0 0 0 0 44 49 1 6 0 0 0 44 50 1 0 0 0 0 45108 1 0 0 0 0 45109 1 0 0 0 0 45110 1 0 0 0 0 46111 1 0 0 0 0 46112 1 0 0 0 0 46113 1 0 0 0 0 47114 1 0 0 0 0 47115 1 0 0 0 0 48116 1 0 0 0 0 48117 1 0 0 0 0 48118 1 0 0 0 0 49119 1 0 0 0 0 49120 1 0 0 0 0 49121 1 0 0 0 0 51 55 1 0 0 0 0 51122 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 52123 1 6 0 0 0 53 56 1 0 0 0 0 53 57 1 0 0 0 0 53124 1 6 0 0 0 54 58 1 0 0 0 0 54 60 1 0 0 0 0 54125 1 6 0 0 0 55 63 1 0 0 0 0 55126 1 0 0 0 0 56 65 1 0 0 0 0 56127 1 1 0 0 0 57 62 1 0 0 0 0 57128 1 0 0 0 0 57129 1 0 0 0 0 58130 1 0 0 0 0 58131 1 0 0 0 0 59 62 1 0 0 0 0 59132 1 0 0 0 0 59133 1 0 0 0 0 60 64 1 0 0 0 0 60134 1 0 0 0 0 60135 1 0 0 0 0 61 64 1 0 0 0 0 61136 1 0 0 0 0 61137 1 0 0 0 0 62139 1 0 0 0 0 62140 1 0 0 0 0 63 67 1 0 0 0 0 63143 1 0 0 0 0 64141 1 0 0 0 0 64142 1 0 0 0 0 65 68 1 0 0 0 0 65144 1 0 0 0 0 65145 1 0 0 0 0 66 67 1 0 0 0 0 66 72 1 1 0 0 0 66146 1 0 0 0 0 67147 1 0 0 0 0 68 70 1 0 0 0 0 68148 1 0 0 0 0 68149 1 0 0 0 0 69 70 1 0 0 0 0 70150 1 0 0 0 0 70151 1 0 0 0 0 71 73 1 0 0 0 0 71152 1 0 0 0 0 73 74 1 0 0 0 0 73155 1 0 0 0 0 74 76 1 0 0 0 0 74156 1 0 0 0 0 75 76 1 0 0 0 0 75 77 1 1 0 0 0 75158 1 0 0 0 0 76159 1 0 0 0 0 M CHG 2 7 -1 19 1 M END > 44242782 > 1 > 2130 > 18 > 8 > 7 > AAADcfB/PgAAAAAAAAAAAAAAAAAAAAAAAAA8ePHiQAAAAADwAAAAHgAECAAADzzxgAcCCAMQBgCIAqHSGAIAAAAgAAAgCAFIAEgREBYAwQQmQAAFpgCPAQPa7fzfgAAAAAAAAADAAAYAADAAAAAAAAAAAA== > (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxy-tetrahydropyran-3-yl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid;(1R,2R,9S,17S)-13-oxido-7-aza-13-azoniatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one > (2S,3S,4S,5R,6R)-6-[[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxy-3-oxanyl]oxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid;(1R,2R,9S,17S)-13-oxido-7-aza-13-azoniatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one > (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid;(1R,2R,9S,17S)-13-oxido-7-aza-13-azoniatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one > (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid;(1R,2R,9S,17S)-13-oxido-7-aza-13-azoniatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one > (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxidanylidene-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid;(1R,2R,9S,17S)-13-oxidanidyl-7-aza-13-azoniatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one > (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-14-keto-4,4,6a,6b,8a,11,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxy-tetrahydropyran-3-yl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid;(1R,2R,9S,17S)-13-oxido-7-aza-13-azoniatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one > InChI=1S/C42H62O16.C15H24N2O2/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50;18-14-7-1-6-13-12-5-3-9-17(19)8-2-4-11(15(12)17)10-16(13)14/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54);11-13,15H,1-10H2/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+;11-,12+,13+,15-,17?/m00/s1 > WRAYTLRLOLUYDJ-MZOXSASHSA-N > 1086.58756390 > C57H86N2O18 > 1087.3 > CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C.C1CC2C3CCC[N+]4(C3C(CCC4)CN2C(=O)C1)[O-] > C[C@]12CC[C@](C[C@H]1C3=CC(=O)[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)C(=O)O)O)O)O)C)(C)C(=O)O.C1C[C@@H]2[C@H]3CCC[N+]4([C@H]3[C@@H](CCC4)CN2C(=O)C1)[O-] > 305 > 1086.58756390 > 0 > 77 > 23 > 1 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 35 1 5 51 1 6 73 14 6 74 15 5 76 16 6 21 37 5 22 39 5 23 78 6 24 40 6 25 79 6 30 84 5 31 48 5 44 49 6 52 123 6 53 124 6 54 125 6 56 127 5 55 6 6 71 6 5 66 72 5 19 7 3 75 77 5 63 8 5 67 9 6 $$$$