74829791 -OEChem-04262405112D 139142 0 1 0 0 0 0 0999 V2000 6.7687 0.0000 0.0000 Co 0 0 0 0 0 0 0 0 0 0 0 0 7.9846 4.3186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2315 5.7724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 2.7098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6829 9.1331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8405 5.9265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4145 10.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9406 13.5125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7592 6.8346 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 7.2206 8.1674 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 4.2961 8.1674 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 5.7266 9.5001 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 7.1278 2.8133 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9119 5.3526 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 3.5759 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9404 7.4203 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3218 6.7593 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4632 11.8493 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5243 14.5094 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5396 6.2496 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2464 5.3079 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8056 7.4521 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2720 5.3079 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7163 7.7128 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9787 6.2170 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7163 8.6870 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2526 4.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3887 5.7214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1993 5.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7730 8.9477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 4.4419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 6.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4353 7.0178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7051 8.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8804 9.6735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8021 7.6802 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7438 7.4195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4813 9.8568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8021 8.6544 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5396 10.1502 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2138 11.0593 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7720 4.4419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7438 8.9151 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2394 11.0593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1217 3.8133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3663 5.7686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3283 8.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9461 10.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1929 6.0476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8023 7.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0045 9.8568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5141 6.7226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0062 9.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2162 10.5350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7894 11.8770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2333 12.0593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2865 11.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 3.5759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3172 8.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1326 10.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 12.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3215 6.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3368 10.8573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9446 13.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9293 7.5689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5525 6.7869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1132 6.9138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6555 5.3734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2870 7.9549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5426 5.7764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6413 4.4118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0441 3.7240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0612 5.1950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9152 5.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7162 6.2479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0114 4.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7902 4.8168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3873 5.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6644 3.8313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3546 4.2298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0015 6.7653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7822 7.5316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2497 9.1320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5079 9.4235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4920 9.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9822 10.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2688 9.7752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2466 8.3790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9686 10.5977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9282 11.6096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8797 5.0525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1894 4.6540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3054 9.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9064 6.1845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9504 5.3088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8262 5.3528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7837 7.7573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5256 7.4658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8965 8.2709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2152 7.8573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5661 10.2953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9204 6.9011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3355 6.1288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1078 6.5440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4141 9.4439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7222 8.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6367 10.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6718 10.9555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7957 10.9907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2267 11.4375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2982 12.2314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8533 12.0631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2296 12.6793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6133 12.0555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4745 11.9533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6957 11.5505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0985 10.7717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6667 2.5066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5928 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7247 10.0679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4166 10.8030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9317 13.2239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8603 12.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5079 5.5232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7616 4.7511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 3.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 4.1128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7137 6.8432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0237 6.2156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 7.2892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4739 7.8652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7321 8.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9698 12.2247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 12.0890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8812 15.0164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9068 14.5650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0676 6.4005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9389 6.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0374 7.1733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 45 2 0 0 0 0 3 49 2 0 0 0 0 4 58 2 0 0 0 0 5 59 2 0 0 0 0 6 62 2 0 0 0 0 7 63 2 0 0 0 0 8 64 2 0 0 0 0 9 20 1 0 0 0 0 9 25 1 0 0 0 0 10 22 1 0 0 0 0 10 30 1 0 0 0 0 11 37 1 0 0 0 0 11 43 1 0 0 0 0 12 40 1 0 0 0 0 12 48 1 0 0 0 0 13 45 1 0 0 0 0 13118 1 0 0 0 0 13119 1 0 0 0 0 14 49 1 0 0 0 0 14124 1 0 0 0 0 14125 1 0 0 0 0 15 58 1 0 0 0 0 15126 1 0 0 0 0 15127 1 0 0 0 0 16 59 1 0 0 0 0 16 65 1 0 0 0 0 16128 1 0 0 0 0 17 62 1 0 0 0 0 17129 1 0 0 0 0 17130 1 0 0 0 0 18 63 1 0 0 0 0 18133 1 0 0 0 0 18134 1 0 0 0 0 19 64 1 0 0 0 0 19135 1 0 0 0 0 19136 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 21 29 1 0 0 0 0 22 24 1 0 0 0 0 22 67 1 0 0 0 0 23 25 1 0 0 0 0 23 31 1 0 0 0 0 23 68 1 0 0 0 0 24 26 1 0 0 0 0 24 33 1 0 0 0 0 24 69 1 0 0 0 0 25 32 1 0 0 0 0 25 70 1 0 0 0 0 26 30 1 0 0 0 0 26 34 1 0 0 0 0 26 35 1 0 0 0 0 27 45 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 28 75 1 0 0 0 0 29 76 1 0 0 0 0 29 77 1 0 0 0 0 29 78 1 0 0 0 0 30 38 2 3 0 0 0 31 42 1 0 0 0 0 31 79 1 0 0 0 0 31 80 1 0 0 0 0 32 37 2 3 0 0 0 32 46 1 0 0 0 0 33 49 1 0 0 0 0 33 81 1 0 0 0 0 33 82 1 0 0 0 0 34 47 1 0 0 0 0 34 83 1 0 0 0 0 34 84 1 0 0 0 0 35 85 1 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 36 37 1 0 0 0 0 36 39 1 0 0 0 0 36 50 1 0 0 0 0 36 52 1 0 0 0 0 38 40 1 0 0 0 0 38 54 1 0 0 0 0 39 43 1 0 0 0 0 39 53 1 0 0 0 0 39 88 1 0 0 0 0 40 41 1 0 0 0 0 40 89 1 0 0 0 0 41 44 1 0 0 0 0 41 55 1 0 0 0 0 41 90 1 0 0 0 0 42 58 1 0 0 0 0 42 91 1 0 0 0 0 42 92 1 0 0 0 0 43 51 1 0 0 0 0 43 93 1 0 0 0 0 44 48 1 0 0 0 0 44 56 1 0 0 0 0 44 57 1 0 0 0 0 46 94 1 0 0 0 0 46 95 1 0 0 0 0 46 96 1 0 0 0 0 47 59 1 0 0 0 0 47 97 1 0 0 0 0 47 98 1 0 0 0 0 48 51 2 3 0 0 0 50 62 1 0 0 0 0 50 99 1 0 0 0 0 50100 1 0 0 0 0 51101 1 0 0 0 0 52102 1 0 0 0 0 52103 1 0 0 0 0 52104 1 0 0 0 0 53 60 1 0 0 0 0 53105 1 0 0 0 0 53106 1 0 0 0 0 54107 1 0 0 0 0 54108 1 0 0 0 0 54109 1 0 0 0 0 55 61 1 0 0 0 0 55110 1 0 0 0 0 55111 1 0 0 0 0 56112 1 0 0 0 0 56113 1 0 0 0 0 56114 1 0 0 0 0 57115 1 0 0 0 0 57116 1 0 0 0 0 57117 1 0 0 0 0 60 63 1 0 0 0 0 60120 1 0 0 0 0 60121 1 0 0 0 0 61 64 1 0 0 0 0 61122 1 0 0 0 0 61123 1 0 0 0 0 65 66 1 0 0 0 0 65131 1 0 0 0 0 65132 1 0 0 0 0 66137 1 0 0 0 0 66138 1 0 0 0 0 66139 1 0 0 0 0 M CHG 4 9 -1 10 -1 11 -1 12 -1 M END > 74829791 > 1 > 2070 > 11 > 7 > 19 > AAADcfB/+AAAAAAQAAAAAAAAAAAAAWLFiwAAAAAAAAAAAAAAAAAAHgAQAAAAD6jBgAQCAALAAACIAiVSUACAAAAgAgAACIEIAAgAQBIAgAAUAAAAlgCIAAMcicCfgAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > cobalt;3-[2,7,18-tris(2-amino-2-oxo-ethyl)-3,13-bis(3-amino-3-oxo-propyl)-17-[3-(ethylamino)-3-oxo-propyl]-1,2,5,7,12,12,15,17-octamethyl-3,4,8,9,13,14,18,19-octahydrocorrin-21,22,23,24-tetraid-8-yl]propanamide > cobalt;3-[2,7,18-tris(2-amino-2-oxoethyl)-3,13-bis(3-amino-3-oxopropyl)-17-[3-(ethylamino)-3-oxopropyl]-1,2,5,7,12,12,15,17-octamethyl-3,4,8,9,13,14,18,19-octahydrocorrin-21,22,23,24-tetraid-8-yl]propanamide > cobalt;3-[2,7,18-tris(2-amino-2-oxoethyl)-3,13-bis(3-amino-3-oxopropyl)-17-[3-(ethylamino)-3-oxopropyl]-1,2,5,7,12,12,15,17-octamethyl-3,4,8,9,13,14,18,19-octahydrocorrin-21,22,23,24-tetraid-8-yl]propanamide > cobalt;3-[2,7,18-tris(2-amino-2-oxoethyl)-3,13-bis(3-amino-3-oxopropyl)-17-[3-(ethylamino)-3-oxopropyl]-1,2,5,7,12,12,15,17-octamethyl-3,4,8,9,13,14,18,19-octahydrocorrin-21,22,23,24-tetraid-8-yl]propanamide > cobalt;3-[2,7,18-tris(2-azanyl-2-oxidanylidene-ethyl)-3,13-bis(3-azanyl-3-oxidanylidene-propyl)-17-[3-(ethylamino)-3-oxidanylidene-propyl]-1,2,5,7,12,12,15,17-octamethyl-3,4,8,9,13,14,18,19-octahydrocorrin-21,22,23,24-tetraid-8-yl]propanamide > cobalt;3-[2,7,18-tris(2-amino-2-keto-ethyl)-3,13-bis(3-amino-3-keto-propyl)-17-[3-(ethylamino)-3-keto-propyl]-1,2,5,7,12,12,15,17-octamethyl-3,4,8,9,13,14,18,19-octahydrocorrin-21,22,23,24-tetraid-8-yl]propionamide > InChI=1S/C47H73N11O7.Co/c1-10-54-37(65)17-18-44(6)28(19-34(51)62)42-47(9)46(8,22-36(53)64)27(13-16-33(50)61)39(58-47)24(3)41-45(7,21-35(52)63)25(11-14-31(48)59)29(55-41)20-30-43(4,5)26(12-15-32(49)60)38(56-30)23(2)40(44)57-42;/h20,25-29,38-39,42H,10-19,21-22H2,1-9H3,(H2,48,59)(H2,49,60)(H2,50,61)(H2,51,62)(H2,52,63)(H2,53,64)(H,54,65);/q-4; > IDGFISSNUAITOT-UHFFFAOYSA-N > 962.502637 > C47H73CoN11O7-4 > 963.1 > CCNC(=O)CCC1(C(C2C3(C(C(C([N-]3)C(=C4C(C(C([N-]4)C=C5C(C(C([N-]5)C(=C1[N-]2)C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C.[Co] > CCNC(=O)CCC1(C(C2C3(C(C(C([N-]3)C(=C4C(C(C([N-]4)C=C5C(C(C([N-]5)C(=C1[N-]2)C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C.[Co] > 292 > 962.502637 > -4 > 66 > 0 > 12 > 0 > 3 > 0 > 2 > -1 > 1 5 255 > 22 10 3 20 28 3 21 29 3 23 31 3 24 33 3 25 32 3 26 35 3 30 38 1 32 37 1 36 52 3 40 38 3 39 53 3 41 55 3 43 51 3 48 51 1 $$$$