70680597 -OEChem-04262422152D 133136 0 1 0 0 0 0 0999 V2000 8.7784 -0.2427 0.0000 Co 0 0 0 0 0 0 0 0 0 0 0 0 12.6697 -2.4726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4884 -4.9018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9756 3.5680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0877 2.0444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0200 -6.0526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5299 4.9585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5421 -2.5713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2411 -0.2796 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 8.8152 -1.5800 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 8.7834 1.0208 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 7.3875 -0.2796 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 14.1848 -1.6332 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0750 -5.5964 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0872 5.0549 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.1367 0.6661 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2979 -5.8680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9249 5.9851 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4934 -1.1929 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8119 -0.9775 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5766 -2.1508 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7005 -0.7231 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7801 0.4819 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7005 0.2275 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2905 -3.0697 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3398 -3.0697 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0536 -2.1826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8486 -1.0093 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0218 1.6233 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5766 1.6552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4955 1.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3081 -1.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8486 0.4501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2587 2.5422 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1347 -1.8964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 2.5422 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9298 -0.7549 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9298 0.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7003 -0.7408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9926 -1.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1030 1.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4962 0.8331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8833 -3.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2332 -4.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3612 -3.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1674 2.1096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7153 3.3476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2437 3.5421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1339 -1.3604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2050 2.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 -2.6381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 0.2177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6418 1.1533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4186 0.4468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1849 -1.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3188 -4.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4822 -4.7911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1164 4.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2116 -0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1022 4.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2143 1.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2123 -5.4631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5237 5.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4157 -1.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2984 -2.5997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2095 0.9291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5831 0.8363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0108 -3.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4605 -1.1093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6142 1.8064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7698 -2.1534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6157 -2.3840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8464 -1.5381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6966 2.4396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0469 -1.3638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2866 -0.5391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6035 -0.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3997 -1.8606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1738 -2.2724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5856 -1.4984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6682 1.8110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8314 1.3547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0408 1.2538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3994 -4.2185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3112 -3.4264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3820 -4.6659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8518 -4.0220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2336 -2.6688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7545 -3.4032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4889 -3.8823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6266 1.6930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5840 2.5688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7082 2.5262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1992 3.6912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2873 2.8990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0230 4.1215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6348 3.4253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7986 -1.8819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5892 -1.7812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4054 2.2787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7918 3.0658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0046 3.4522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0042 -2.2223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0482 -3.0980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9239 -3.0540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9437 0.8376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3101 0.2314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9163 -0.4021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2355 1.3319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4632 1.7470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 0.9748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0834 -0.0748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8741 0.0261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1701 -3.8669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7003 -4.5108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6326 3.9201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5444 4.7123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5469 -0.4524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7562 -0.5531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4852 -2.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5042 -1.1019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6912 -5.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8263 -6.1644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6195 5.3729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5457 5.3568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6301 1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2152 0.0511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2318 -6.4844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7970 -5.5025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5574 6.4844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5411 6.0536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4151 -0.5778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 55 2 0 0 0 0 3 57 2 0 0 0 0 4 60 2 0 0 0 0 5 61 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 23 1 0 0 0 0 10 21 1 0 0 0 0 10 27 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 28 1 0 0 0 0 12 33 1 0 0 0 0 13 55 1 0 0 0 0 13120 1 0 0 0 0 13121 1 0 0 0 0 14 57 1 0 0 0 0 14122 1 0 0 0 0 14123 1 0 0 0 0 15 60 1 0 0 0 0 15124 1 0 0 0 0 15125 1 0 0 0 0 16 61 1 0 0 0 0 16126 1 0 0 0 0 16127 1 0 0 0 0 17 62 1 0 0 0 0 17128 1 0 0 0 0 17129 1 0 0 0 0 18 63 1 0 0 0 0 18130 1 0 0 0 0 18131 1 0 0 0 0 19 64 1 0 0 0 0 19132 1 0 0 0 0 19133 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 1 0 0 0 21 25 1 0 0 0 0 21 65 1 6 0 0 0 22 24 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 1 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 23 66 1 0 0 0 0 24 42 1 1 0 0 0 24 67 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 6 0 0 0 25 68 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 6 0 0 0 27 35 2 0 0 0 0 28 35 1 0 0 0 0 28 37 1 0 0 0 0 28 69 1 0 0 0 0 29 36 1 0 0 0 0 29 41 1 0 0 0 0 29 70 1 0 0 0 0 30 31 2 0 0 0 0 30 34 1 0 0 0 0 31 46 1 0 0 0 0 32 71 1 0 0 0 0 32 72 1 0 0 0 0 32 73 1 0 0 0 0 33 38 1 0 0 0 0 33 41 2 0 0 0 0 34 36 1 0 0 0 0 34 48 1 0 0 0 0 34 50 1 1 0 0 0 35 51 1 0 0 0 0 36 47 1 1 0 0 0 36 74 1 0 0 0 0 37 38 1 0 0 0 0 37 49 1 1 0 0 0 37 75 1 0 0 0 0 38 52 1 0 0 0 0 38 53 1 0 0 0 0 39 55 1 0 0 0 0 39 76 1 0 0 0 0 39 77 1 0 0 0 0 40 78 1 0 0 0 0 40 79 1 0 0 0 0 40 80 1 0 0 0 0 41 81 1 0 0 0 0 42 54 1 0 0 0 0 42 82 1 0 0 0 0 42 83 1 0 0 0 0 43 57 1 0 0 0 0 43 84 1 0 0 0 0 43 85 1 0 0 0 0 44 56 1 0 0 0 0 44 86 1 0 0 0 0 44 87 1 0 0 0 0 45 88 1 0 0 0 0 45 89 1 0 0 0 0 45 90 1 0 0 0 0 46 91 1 0 0 0 0 46 92 1 0 0 0 0 46 93 1 0 0 0 0 47 58 1 0 0 0 0 47 94 1 0 0 0 0 47 95 1 0 0 0 0 48 60 1 0 0 0 0 48 96 1 0 0 0 0 48 97 1 0 0 0 0 49 59 1 0 0 0 0 49 98 1 0 0 0 0 49 99 1 0 0 0 0 50100 1 0 0 0 0 50101 1 0 0 0 0 50102 1 0 0 0 0 51103 1 0 0 0 0 51104 1 0 0 0 0 51105 1 0 0 0 0 52106 1 0 0 0 0 52107 1 0 0 0 0 52108 1 0 0 0 0 53109 1 0 0 0 0 53110 1 0 0 0 0 53111 1 0 0 0 0 54 61 1 0 0 0 0 54112 1 0 0 0 0 54113 1 0 0 0 0 56 62 1 0 0 0 0 56114 1 0 0 0 0 56115 1 0 0 0 0 58 63 1 0 0 0 0 58116 1 0 0 0 0 58117 1 0 0 0 0 59 64 1 0 0 0 0 59118 1 0 0 0 0 59119 1 0 0 0 0 M CHG 4 9 -1 10 -1 11 -1 12 -1 M END > 70680597 > 1 > 2040 > 11 > 7 > 18 > AAADcfB/+AAAAAAQAAAAAAAAAAAAAWLFixYgQIAAAAAWLEAAAAAAHgAQAAAAD6jBgAQCAAJAAACIAiVSUACAAAAgAgAACAEIAAgAQBIAgAAUAAAAkACIAAMcicCfgAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > cobalt;3-[(1R,2S,3S,5Z,7S,8S,10Z,13S,15Z,17R,18R,19R)-2,7,18-tris(2-amino-2-oxo-ethyl)-3,13,17-tris(3-amino-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-[(1R,2S,3S,5Z,7S,8S,10Z,13S,15Z,17R,18R,19R)-2,7,18-tris(2-amino-2-oxoethyl)-3,13,17-tris(3-amino-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-[(1R,2S,3S,5Z,7S,8S,10Z,13S,15Z,17R,18R,19R)-2,7,18-tris(2-amino-2-oxoethyl)-3,13,17-tris(3-amino-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-[(1R,2S,3S,5Z,7S,8S,10Z,13S,15Z,17R,18R,19R)-2,7,18-tris(2-amino-2-oxoethyl)-3,13,17-tris(3-amino-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-[(1R,2S,3S,5Z,7S,8S,10Z,13S,15Z,17R,18R,19R)-2,7,18-tris(2-azanyl-2-oxidanylidene-ethyl)-3,13,17-tris(3-azanyl-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-[(1R,2S,3S,5Z,7S,8S,10Z,13S,15Z,17R,18R,19R)-2,7,18-tris(2-amino-2-keto-ethyl)-3,13,17-tris(3-amino-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/C45H69N11O7.Co/c1-21-36-24(10-13-30(47)58)41(3,4)28(54-36)18-27-23(9-12-29(46)57)43(6,19-34(51)62)39(53-27)22(2)37-25(11-14-31(48)59)44(7,20-35(52)63)45(8,56-37)40-26(17-33(50)61)42(5,38(21)55-40)16-15-32(49)60;/h18,23-27,36-37,40H,9-17,19-20H2,1-8H3,(H2,46,57)(H2,47,58)(H2,48,59)(H2,49,60)(H2,50,61)(H2,51,62)(H2,52,63);/q-4;/b28-18-,38-21-,39-22-;/t23-,24-,25-,26+,27?,36?,37?,40-,42-,43+,44+,45+;/m1./s1 > NULVYENALIQVNI-TUBFGSOZSA-N > 934.471337 > C45H69CoN11O7-4 > 935.0 > CC1=C2C(C(C([N-]2)C3(C(C(C([N-]3)C(=C4C(C(C([N-]4)C=C5C(C(C1[N-]5)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)CCC(=O)N.[Co] > C/C/1=C/2\[C@@]([C@@H](C([N-]2)/C=C\3/C([C@@H](C([N-]3)/C(=C\4/[C@]([C@H]([C@@H]([N-]4)[C@]5([C@@]([C@@H](C1[N-]5)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)(C)CCC(=O)N)/C)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N.[Co] > 306 > 934.471337 > -4 > 64 > 9 > 3 > 3 > 0 > 0 > 2 > -1 > 1 10 6 1 11 6 1 12 6 1 9 6 > 1 5 255 > 20 32 5 21 65 6 22 40 5 23 31 3 24 42 5 25 43 6 26 45 6 28 35 3 29 41 3 34 50 5 36 47 5 37 49 5 $$$$