5476353 -OEChem-05132403202D 97107 0 1 0 0 0 0 0999 V2000 7.3097 1.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6515 2.5848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8286 -2.6316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4426 -2.9129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0461 -0.1966 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.8170 -1.4664 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 11.6727 3.3624 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 13.7808 -0.3079 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0106 0.2862 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7703 -0.4885 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3675 0.0937 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0938 0.8398 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8189 -0.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3644 1.5835 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1004 1.1074 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5458 -2.1275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2688 -1.4434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2801 -0.1058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3601 -1.0605 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5492 -1.1841 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3761 2.0686 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9753 -2.6475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2054 -1.2633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9295 0.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4093 2.3798 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3042 -2.3571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5359 -1.6745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6641 2.8290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1505 1.4138 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6642 2.2975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0447 -2.8934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8410 2.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 -2.0793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9955 -2.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4222 0.6192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1993 1.2485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5368 -1.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0844 -4.2284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1727 4.2284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4629 -3.9539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0316 0.7050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7735 -0.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2377 -1.1475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0278 0.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4937 -0.9990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7671 -3.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7650 0.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4961 -0.7396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2754 0.7068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5330 0.4022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8733 -0.8274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4367 -0.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9975 0.4960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6493 -2.7388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1657 -2.1177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1882 0.5073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6643 -0.1777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5245 -1.6583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1692 -1.1854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5789 2.6545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 -3.0096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2570 -3.1998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5236 0.0795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3461 0.0891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4139 1.7598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9249 -2.8475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8193 -2.7022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1826 3.1691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4178 3.3980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6528 1.7773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1069 2.7316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2301 2.7401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2216 1.8634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6634 -2.9343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4488 2.3044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8219 2.8018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3978 -2.2123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2502 -1.0816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3200 -4.8019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7096 4.5384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8627 4.7654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6358 3.9184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0517 -4.4179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4769 -2.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6672 -2.9982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5231 -2.8079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7171 -0.8108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9009 -1.6681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7582 -1.4843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1819 1.5880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3258 -1.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1482 -3.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7289 -4.2485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3859 -3.6678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3634 0.4226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9324 -1.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 14 1 0 0 0 0 2 14 1 0 0 0 0 2 28 1 0 0 0 0 3 33 1 0 0 0 0 3 47 1 0 0 0 0 4 33 2 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 5 23 1 0 0 0 0 6 11 1 0 0 0 0 6 22 1 0 0 0 0 6 26 1 0 0 0 0 7 25 1 0 0 0 0 7 29 1 0 0 0 0 7 39 1 0 0 0 0 8 35 1 0 0 0 0 8 42 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 11 18 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 51 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 30 1 0 0 0 0 15 21 1 0 0 0 0 15 24 1 0 0 0 0 15 54 1 0 0 0 0 16 22 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 23 1 0 0 0 0 17 31 2 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 19 59 1 0 0 0 0 20 33 1 0 0 0 0 20 60 1 0 0 0 0 21 25 1 0 0 0 0 21 28 1 0 0 0 0 21 61 1 0 0 0 0 22 62 1 0 0 0 0 22 63 1 0 0 0 0 23 34 2 0 0 0 0 24 29 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 25 32 1 0 0 0 0 25 66 1 0 0 0 0 26 27 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 27 37 2 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 29 35 1 0 0 0 0 29 71 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 30 74 1 0 0 0 0 31 38 1 0 0 0 0 31 75 1 0 0 0 0 32 36 1 0 0 0 0 32 76 1 0 0 0 0 32 77 1 0 0 0 0 34 40 1 0 0 0 0 34 78 1 0 0 0 0 35 36 2 0 0 0 0 36 41 1 0 0 0 0 37 43 1 0 0 0 0 37 79 1 0 0 0 0 38 40 2 0 0 0 0 38 80 1 0 0 0 0 39 81 1 0 0 0 0 39 82 1 0 0 0 0 39 83 1 0 0 0 0 40 84 1 0 0 0 0 41 42 1 0 0 0 0 41 45 2 0 0 0 0 42 46 2 0 0 0 0 43 85 1 0 0 0 0 43 86 1 0 0 0 0 43 87 1 0 0 0 0 44 88 1 0 0 0 0 44 89 1 0 0 0 0 44 90 1 0 0 0 0 45 48 1 0 0 0 0 45 91 1 0 0 0 0 46 49 1 0 0 0 0 46 92 1 0 0 0 0 47 93 1 0 0 0 0 47 94 1 0 0 0 0 47 95 1 0 0 0 0 48 49 2 0 0 0 0 48 96 1 0 0 0 0 49 97 1 0 0 0 0 M END > 5476353 > 1 > 1440 > 7 > 0 > 2 > AAADcfB/uAAAAAAAAAAAAAAAAAAAAWLAAAA8eLFiwAAYAFix9AAAHgAAAAAADyzhngYyyPMMFACoAyTyTACCgCAhAiAI2CG4ZJgaYPLAkbG/IAhmwAHcyAe4+f+fgAAAAAACAAAAAAAAAAQAAAAAAAAAAA== > methyl (27Z)-27-ethylidene-8,21,40-trimethyl-20,22-dioxa-8,25,30,40-tetrazaundecacyclo[23.11.2.16,17.124,28.01,23.03,21.04,18.07,15.09,14.023,30.031,36]tetraconta-7(15),9,11,13,31,33,35-heptaene-29-carboxylate > (27Z)-27-ethylidene-8,21,40-trimethyl-20,22-dioxa-8,25,30,40-tetrazaundecacyclo[23.11.2.16,17.124,28.01,23.03,21.04,18.07,15.09,14.023,30.031,36]tetraconta-7(15),9,11,13,31,33,35-heptaene-29-carboxylic acid methyl ester > methyl (27Z)-27-ethylidene-8,21,40-trimethyl-20,22-dioxa-8,25,30,40-tetrazaundecacyclo[23.11.2.16,17.124,28.01,23.03,21.04,18.07,15.09,14.023,30.031,36]tetraconta-7(15),9,11,13,31,33,35-heptaene-29-carboxylate > methyl (27Z)-27-ethylidene-8,21,40-trimethyl-20,22-dioxa-8,25,30,40-tetrazaundecacyclo[23.11.2.16,17.124,28.01,23.03,21.04,18.07,15.09,14.023,30.031,36]tetraconta-7(15),9,11,13,31,33,35-heptaene-29-carboxylate > methyl (27Z)-27-ethylidene-8,21,40-trimethyl-20,22-dioxa-8,25,30,40-tetrazaundecacyclo[23.11.2.16,17.124,28.01,23.03,21.04,18.07,15.09,14.023,30.031,36]tetraconta-7(15),9,11,13,31,33,35-heptaene-29-carboxylate > (27Z)-27-ethylidene-8,21,40-trimethyl-20,22-dioxa-8,25,30,40-tetrazaundecacyclo[23.11.2.16,17.124,28.01,23.03,21.04,18.07,15.09,14.023,30.031,36]tetraconta-7(15),9,11,13,31,33,35-heptaene-29-carboxylic acid methyl ester > InChI=1S/C41H48N4O4/c1-6-23-21-44-16-15-40-20-30-26-17-34-36-27(24-11-7-9-13-31(24)43(36)4)18-33(42(34)3)28(26)22-48-39(30,2)49-41(40)35(44)19-25(23)37(38(46)47-5)45(41)32-14-10-8-12-29(32)40/h6-14,25-26,28,30,33-35,37H,15-22H2,1-5H3/b23-6+ > XXNYZYBYNFRERU-TXNBCWFRSA-N > 5.2 > 660.36755603 > C41H48N4O4 > 660.8 > CC=C1CN2CCC34CC5C6CC7C8=C(CC(C6COC5(OC39C2CC1C(N9C1=CC=CC=C41)C(=O)OC)C)N7C)C1=CC=CC=C1N8C > C/C=C/1\CN2CCC34CC5C6CC7C8=C(CC(C6COC5(OC39C2CC1C(N9C1=CC=CC=C41)C(=O)OC)C)N7C)C1=CC=CC=C1N8C > 59.4 > 660.36755603 > 0 > 49 > 0 > 11 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 10 16 3 11 18 3 12 13 3 14 30 3 15 24 3 17 23 8 17 31 8 19 18 3 20 33 3 21 28 3 23 34 8 29 24 3 25 32 3 31 38 8 34 40 8 35 36 8 36 41 8 38 40 8 41 42 8 41 45 8 42 46 8 45 48 8 46 49 8 48 49 8 8 35 8 8 42 8 9 11 3 $$$$