25241468 -OEChem-05052420572D 126129 0 1 0 0 0 0 0999 V2000 8.1005 -3.0400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8736 -4.4928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1097 -4.0059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1005 -2.0400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 -0.6563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0593 4.6860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6232 -3.6523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3862 5.6519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3779 -2.3577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3170 2.7676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4325 -1.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0025 3.2579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3984 -1.1563 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2345 -2.5400 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9783 -3.5557 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2228 -3.5557 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1005 -4.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9666 -2.5400 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3685 -3.0400 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5025 -2.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5025 -1.5400 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4850 -4.4179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1274 2.7541 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8326 -3.0400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0933 3.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4203 3.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3521 3.9788 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6450 4.6860 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6791 4.4271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5324 -0.6563 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6364 -1.0400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3984 -2.1563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 0.3437 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5324 0.3437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2644 -0.6563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4203 2.0470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9343 0.8437 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.3984 0.8437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2644 0.3437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5074 1.0508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7613 -0.5740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9343 1.8437 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6664 -1.1563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6364 -0.0400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0396 -5.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1438 -4.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2272 2.5508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0215 -0.1525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0025 1.3260 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4734 0.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5025 0.4600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2613 2.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6364 -0.0400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2091 1.9348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0252 4.4271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4158 2.5436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4919 2.1609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8138 -1.8014 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 9.5897 -3.6587 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 6.6835 -3.8616 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 8.4105 -4.6040 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 7.7905 -4.6040 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 6.9861 -2.9859 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 4.9036 -2.3794 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 5.0641 -2.9784 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 6.1013 -1.7004 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 9.9630 -4.8127 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 10.0195 -4.1038 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 9.2774 -5.0021 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 9.0402 1.7579 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 10.6922 2.8524 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 10.2538 2.4140 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 7.8214 3.6217 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 8.2598 2.8623 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 10.9510 3.8184 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 10.0834 5.1244 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 8.5186 5.0260 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 8.0802 4.5876 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 8.6824 -0.6563 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 4.0376 -1.2004 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 4.4760 -1.6388 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 8.3622 0.0817 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 8.9498 0.5557 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 9.1337 -0.1311 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 8.1005 -1.4200 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 11.8844 -0.6563 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 11.5744 -1.1932 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 7.8584 2.3090 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 6.4960 1.2821 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 10.8734 1.2422 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 10.1864 1.4263 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 11.8844 0.3437 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 11.5744 0.8806 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 5.1624 -0.7345 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 5.3229 -0.1356 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 6.3602 -0.7345 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 7.4572 1.5106 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 7.1426 -6.0903 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 6.4283 -5.5819 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 7.6510 -5.3759 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 5.9172 3.0877 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 6.5372 3.0877 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 4.5449 -4.4252 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 5.3042 -4.8636 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 4.9833 -3.6658 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 7.6392 -0.0984 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 7.0756 -0.7701 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 6.4596 0.1097 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 4.4297 1.0888 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 9.5274 1.4096 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 10.0722 0.6315 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 9.9118 0.3536 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 5.9409 0.8984 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 9.8246 6.0903 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 3.6364 -0.6599 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 3.0164 -0.0400 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 3.6364 0.5800 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 3.8317 1.4429 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 4.2900 2.5495 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 12.6241 4.2667 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 12.1856 5.0260 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 11.8647 3.8282 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 7.1306 3.3589 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 3.4966 3.1582 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5383 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 2.4110 1.5462 0.0000 H 1 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 18 1 0 0 0 0 16 2 1 6 0 0 0 2 45 1 0 0 0 0 19 3 1 1 0 0 0 3 46 1 0 0 0 0 18 4 1 6 0 0 0 4 85 1 0 0 0 0 5 33 1 0 0 0 0 5 43 1 0 0 0 0 27 6 1 6 0 0 0 6 55 1 0 0 0 0 7 24 2 0 0 0 0 28 8 1 1 0 0 0 8114 1 0 0 0 0 9 32 2 0 0 0 0 42 10 1 6 0 0 0 10123 1 0 0 0 0 11 43 2 0 0 0 0 12 52 2 0 0 0 0 13 30 1 0 0 0 0 13 32 1 0 0 0 0 13 35 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 14 58 1 6 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 15 22 1 6 0 0 0 15 59 1 0 0 0 0 16 17 1 0 0 0 0 16 60 1 0 0 0 0 17 61 1 0 0 0 0 17 62 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 63 1 0 0 0 0 20 21 1 0 0 0 0 20 64 1 0 0 0 0 20 65 1 0 0 0 0 21 31 1 0 0 0 0 21 41 1 6 0 0 0 21 66 1 0 0 0 0 22 67 1 0 0 0 0 22 68 1 0 0 0 0 22 69 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 23 36 1 6 0 0 0 23 70 1 0 0 0 0 24 32 1 0 0 0 0 25 27 1 0 0 0 0 25 71 1 0 0 0 0 25 72 1 0 0 0 0 26 29 1 0 0 0 0 26 73 1 0 0 0 0 26 74 1 0 0 0 0 27 28 1 0 0 0 0 27 75 1 0 0 0 0 28 29 1 0 0 0 0 28 76 1 0 0 0 0 29 77 1 0 0 0 0 29 78 1 0 0 0 0 30 34 1 0 0 0 0 30 43 1 0 0 0 0 30 79 1 1 0 0 0 31 44 1 0 0 0 0 31 80 1 0 0 0 0 31 81 1 0 0 0 0 33 37 1 0 0 0 0 33 40 1 6 0 0 0 33 82 1 0 0 0 0 34 38 1 0 0 0 0 34 83 1 0 0 0 0 34 84 1 0 0 0 0 35 39 1 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 36 40 2 3 0 0 0 36 88 1 0 0 0 0 37 42 1 0 0 0 0 37 48 1 6 0 0 0 37 89 1 0 0 0 0 38 39 1 0 0 0 0 38 90 1 0 0 0 0 38 91 1 0 0 0 0 39 92 1 0 0 0 0 39 93 1 0 0 0 0 40 50 1 0 0 0 0 41 94 1 0 0 0 0 41 95 1 0 0 0 0 41 96 1 0 0 0 0 42 47 1 0 0 0 0 42 97 1 0 0 0 0 44 51 2 0 0 0 0 44 53 1 0 0 0 0 45 98 1 0 0 0 0 45 99 1 0 0 0 0 45100 1 0 0 0 0 46103 1 0 0 0 0 46104 1 0 0 0 0 46105 1 0 0 0 0 47 52 1 0 0 0 0 47101 1 0 0 0 0 47102 1 0 0 0 0 48106 1 0 0 0 0 48107 1 0 0 0 0 48108 1 0 0 0 0 49 51 1 0 0 0 0 49 52 1 0 0 0 0 49 54 1 1 0 0 0 49109 1 0 0 0 0 50110 1 0 0 0 0 50111 1 0 0 0 0 50112 1 0 0 0 0 51113 1 0 0 0 0 53115 1 0 0 0 0 53116 1 0 0 0 0 53117 1 0 0 0 0 54 56 1 0 0 0 0 54118 1 0 0 0 0 54119 1 0 0 0 0 55120 1 0 0 0 0 55121 1 0 0 0 0 55122 1 0 0 0 0 56 57 2 0 0 0 0 56124 1 0 0 0 0 57125 1 0 0 0 0 57126 1 0 0 0 0 M ISO 8 58 2 59 2 60 2 61 2 62 2 63 2 64 2 65 2 M ISO 8 66 2 67 2 68 2 69 2 70 2 71 2 72 2 73 2 M ISO 8 74 2 75 2 76 2 77 2 78 2 79 2 80 2 81 2 M ISO 8 82 2 83 2 84 2 85 2 86 2 87 2 88 2 89 2 M ISO 8 90 2 91 2 92 2 93 2 94 2 95 2 96 2 97 2 M ISO 8 98 2 99 2 100 2 101 2 102 2 103 2 104 2 105 2 M ISO 8 106 2 107 2 108 2 109 2 110 2 111 2 112 2 113 2 M ISO 8 114 2 115 2 116 2 117 2 118 2 119 2 120 2 121 2 M ISO 5 122 2 123 2 124 2 125 2 126 2 M END > 25241468 > 1 > 1480 > 12 > 3 > 7 > AAADcfB+PAAAAAAAAAAAAAAAAAAAAAAAAAA8SIAAAAAAAAAAAAAAHgAACAAADTzhgAYCCAMABgCIAqHSGAIAAAAgAAAICAHIAAgTFBYAoSQHUAAHpgCfIAPY7PTOAAAAAAAAAABAAAIAAACAAAAAAAAAAA== > (1R,9S,12R,13R,14S,17R,18E,21S,23S,24R,25S,27R)-5,5,6,6,7,7,8,8,9,12,13,14,15,15,17,18,20,20,21,22,22,23,24,25,26,26,27-heptacosadeuterio-12-[2-deuterio-2-[(1R,4R,5R)-1,2,2,3,3,4,5,6,6-nonadeuterio-4-deuteriooxy-5-(trideuteriomethoxy)cyclohexyl]-1-(trideuteriomethyl)vinyl]-1,14-dideuteriooxy-17-(1,1,2,3,3-pentadeuterioallyl)-23,25-bis(trideuteriomethoxy)-13,19,21,27-tetrakis(trideuteriomethyl)-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone > (1R,9S,12R,13R,14S,17R,18E,21S,23S,24R,25S,27R)-5,5,6,6,7,7,8,8,9,12,13,14,15,15,17,18,20,20,21,22,22,23,24,25,26,26,27-heptacosadeuterio-1,14-dideuteriooxy-17-(1,1,2,3,3-pentadeuterioprop-2-enyl)-12-[1,3,3,3-tetradeuterio-1-[(1R,4R,5R)-1,2,2,3,3,4,5,6,6-nonadeuterio-4-deuteriooxy-5-(trideuteriomethoxy)cyclohexyl]prop-1-en-2-yl]-23,25-bis(trideuteriomethoxy)-13,19,21,27-tetrakis(trideuteriomethyl)-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone > (1R,9S,12R,13R,14S,17R,18E,21S,23S,24R,25S,27R)-5,5,6,6,7,7,8,8,9,12,13,14,15,15,17,18,20,20,21,22,22,23,24,25,26,26,27-heptacosadeuterio-1,14-dideuteriooxy-17-(1,1,2,3,3-pentadeuterioprop-2-enyl)-12-[1,3,3,3-tetradeuterio-1-[(1R,4R,5R)-1,2,2,3,3,4,5,6,6-nonadeuterio-4-deuteriooxy-5-(trideuteriomethoxy)cyclohexyl]prop-1-en-2-yl]-23,25-bis(trideuteriomethoxy)-13,19,21,27-tetrakis(trideuteriomethyl)-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone > (1R,9S,12R,13R,14S,17R,18E,21S,23S,24R,25S,27R)-5,5,6,6,7,7,8,8,9,12,13,14,15,15,17,18,20,20,21,22,22,23,24,25,26,26,27-heptacosadeuterio-1,14-dideuteriooxy-17-(1,1,2,3,3-pentadeuterioprop-2-enyl)-12-[1,3,3,3-tetradeuterio-1-[(1R,4R,5R)-1,2,2,3,3,4,5,6,6-nonadeuterio-4-deuteriooxy-5-(trideuteriomethoxy)cyclohexyl]prop-1-en-2-yl]-23,25-bis(trideuteriomethoxy)-13,19,21,27-tetrakis(trideuteriomethyl)-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone > (1R,9S,12R,13R,14S,17R,18E,21S,23S,24R,25S,27R)-5,5,6,6,7,7,8,8,9,12,13,14,15,15,17,18,20,20,21,22,22,23,24,25,26,26,27-heptacosadeuterio-1,14-dideuteriooxy-17-(1,1,2,3,3-pentadeuterioprop-2-enyl)-12-[1,3,3,3-tetradeuterio-1-[(1R,4R,5R)-1,2,2,3,3,4,5,6,6-nonadeuterio-4-deuteriooxy-5-(trideuteriomethoxy)cyclohexyl]prop-1-en-2-yl]-23,25-bis(trideuteriomethoxy)-13,19,21,27-tetrakis(trideuteriomethyl)-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone > (1R,9S,12R,13R,14S,17R,18E,21S,23S,24R,25S,27R)-5,5,6,6,7,7,8,8,9,12,13,14,15,15,17,18,20,20,21,22,22,23,24,25,26,26,27-heptacosadeuterio-12-[2-deuterio-2-[(1R,4R,5R)-1,2,2,3,3,4,5,6,6-nonadeuterio-4-deuteriooxy-5-(trideuteriomethoxy)cyclohexyl]-1-(trideuteriomethyl)vinyl]-1,14-dideuteriooxy-17-(1,1,2,3,3-pentadeuterioallyl)-23,25-bis(trideuteriomethoxy)-13,19,21,27-tetrakis(trideuteriomethyl)-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-diquinone > InChI=1S/C44H69NO12/c1-10-13-31-19-25(2)18-26(3)20-37(54-8)40-38(55-9)22-28(5)44(52,57-40)41(49)42(50)45-17-12-11-14-32(45)43(51)56-39(29(6)34(47)24-35(31)48)27(4)21-30-15-16-33(46)36(23-30)53-7/h10,19,21,26,28-34,36-40,46-47,52H,1,11-18,20,22-24H2,2-9H3/b25-19+,27-21?/t26-,28+,29+,30-,31+,32-,33+,34-,36+,37-,38-,39-,40+,44+/m0/s1/i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