53462546 -OEChem-05132415552D 104106 0 1 0 0 0 0 0999 V2000 8.0378 -4.0198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3241 2.0146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7088 0.5447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7515 2.0146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6152 4.0345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2154 2.0546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1611 -0.4953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3667 0.5447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9144 -0.4953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5679 -4.0440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5921 2.0346 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4292 -0.4753 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1922 4.0545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6464 -0.4753 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4834 2.0346 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0378 -2.0198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8833 4.0545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5679 -1.9957 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7319 2.5446 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8602 2.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4407 0.5247 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4603 4.0345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3320 3.5445 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3125 1.0146 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5806 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8486 1.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6348 0.5247 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7435 3.5445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7630 1.0146 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1717 -2.5198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3436 2.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9038 -2.5198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2778 -1.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7977 -1.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4487 5.0344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6001 3.5245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9038 -3.5198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1717 -3.5198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2894 -0.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4950 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1727 0.5047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7862 -0.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7977 -4.0545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2778 -4.0545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7038 -2.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3717 -2.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7038 -3.5406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9029 0.5047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3717 -3.5406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1807 5.0544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7862 -5.0544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2894 -5.0544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8949 5.0544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2724 2.8484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3935 1.7384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9741 0.2085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4675 3.4145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8725 3.2407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1326 2.3384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7792 1.3308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3162 3.0979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 2.8808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6838 2.0313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2287 1.0619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8414 0.4347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4686 1.0475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1015 0.2085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8887 -0.7790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2226 1.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0687 5.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4416 5.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8288 5.0272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2839 4.0578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0668 3.2083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9163 2.9912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7327 3.7507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1868 -0.7790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8565 -0.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7060 0.1885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4889 1.0380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9429 2.3384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 -2.1869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3428 3.7507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5867 1.0380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3696 0.1885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2190 -0.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 -3.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8645 2.3183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8006 5.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1735 5.6744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5607 5.0472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1662 -5.0472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7790 -5.6744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4061 -5.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6694 -5.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2965 -5.6744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9093 -5.0472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5148 5.0472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 5.6744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2749 5.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2110 2.3183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1060 -2.3036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5655 -1.3757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 24 1 0 0 0 0 2 89 1 0 0 0 0 3 25 2 0 0 0 0 4 30 1 0 0 0 0 4102 1 0 0 0 0 5 29 2 0 0 0 0 6 32 2 0 0 0 0 7 40 2 0 0 0 0 8 41 2 0 0 0 0 9 43 2 0 0 0 0 10 48 2 0 0 0 0 11 19 1 0 0 0 0 11 25 1 0 0 0 0 11 60 1 0 0 0 0 12 21 1 0 0 0 0 12 40 1 0 0 0 0 12 69 1 0 0 0 0 13 23 1 0 0 0 0 13 51 1 0 0 0 0 13 77 1 0 0 0 0 14 28 1 0 0 0 0 14 43 1 0 0 0 0 14 78 1 0 0 0 0 15 32 1 0 0 0 0 15 41 1 0 0 0 0 15 82 1 0 0 0 0 16 31 1 0 0 0 0 16 33 2 0 0 0 0 17 29 1 0 0 0 0 17 54 1 0 0 0 0 17 84 1 0 0 0 0 18 46 1 0 0 0 0 18103 1 0 0 0 0 18104 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 19 55 1 0 0 0 0 20 26 1 0 0 0 0 20 27 1 0 0 0 0 20 56 1 0 0 0 0 21 24 1 0 0 0 0 21 25 1 0 0 0 0 21 57 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 58 1 0 0 0 0 23 32 1 0 0 0 0 23 59 1 0 0 0 0 24 42 1 0 0 0 0 24 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 28 30 1 0 0 0 0 28 41 1 0 0 0 0 28 68 1 0 0 0 0 30 49 1 0 0 0 0 30 70 1 0 0 0 0 31 34 2 0 0 0 0 31 39 1 0 0 0 0 33 35 1 0 0 0 0 33 38 1 0 0 0 0 34 40 1 0 0 0 0 34 47 1 0 0 0 0 35 43 1 0 0 0 0 35 46 2 0 0 0 0 36 71 1 0 0 0 0 36 72 1 0 0 0 0 36 73 1 0 0 0 0 37 74 1 0 0 0 0 37 75 1 0 0 0 0 37 76 1 0 0 0 0 38 44 2 0 0 0 0 39 45 2 0 0 0 0 42 79 1 0 0 0 0 42 80 1 0 0 0 0 42 81 1 0 0 0 0 44 48 1 0 0 0 0 44 52 1 0 0 0 0 45 50 1 0 0 0 0 45 53 1 0 0 0 0 46 48 1 0 0 0 0 47 50 2 0 0 0 0 47 83 1 0 0 0 0 49 85 1 0 0 0 0 49 86 1 0 0 0 0 49 87 1 0 0 0 0 50 88 1 0 0 0 0 51 90 1 0 0 0 0 51 91 1 0 0 0 0 51 92 1 0 0 0 0 52 93 1 0 0 0 0 52 94 1 0 0 0 0 52 95 1 0 0 0 0 53 96 1 0 0 0 0 53 97 1 0 0 0 0 53 98 1 0 0 0 0 54 99 1 0 0 0 0 54100 1 0 0 0 0 54101 1 0 0 0 0 M END > 53462546 > 1 > 1620 > 13 > 9 > 14 > AAADcfB//AAAAAAAAAAAAAAAAAAAAAAAAAAwQIAAAAAAAACBAAAAHgAQCAAADTzhmAYyxoLABgCoA6VyVASCCAAkIAAIiIGtTNgOdj6E9buXeajm9jGY6ce6yDCOQAABQAAKEACAAAKAABQgAAAAAAAAAA== > 2-amino-N1-[2-hydroxy-1-[[3-methyl-2-(methylamino)butanoyl]carbamoyl]propyl]-N9-[2-hydroxy-1-[[2-methyl-1-(methylcarbamoyl)propyl]carbamoyl]propyl]-4,6-dimethyl-3-oxo-phenoxazine-1,9-dicarboxamide > 2-amino-N9-[3-hydroxy-1-[[3-methyl-1-(methylamino)-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-N1-[3-hydroxy-1-[[3-methyl-2-(methylamino)-1-oxobutyl]amino]-1-oxobutan-2-yl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide > 2-amino-1-N-[3-hydroxy-1-[[3-methyl-2-(methylamino)butanoyl]amino]-1-oxobutan-2-yl]-9-N-[3-hydroxy-1-[[3-methyl-1-(methylamino)-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide > 2-amino-1-N-[3-hydroxy-1-[[3-methyl-2-(methylamino)butanoyl]amino]-1-oxobutan-2-yl]-9-N-[3-hydroxy-1-[[3-methyl-1-(methylamino)-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide > 2-azanyl-4,6-dimethyl-N1-[1-[[3-methyl-2-(methylamino)butanoyl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]-N9-[1-[[3-methyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]-3-oxidanylidene-phenoxazine-1,9-dicarboxamide > 2-amino-N-[2-hydroxy-1-[[3-methyl-2-(methylamino)butanoyl]carbamoyl]propyl]-N'-[2-hydroxy-1-[[2-methyl-1-(methylcarbamoyl)propyl]carbamoyl]propyl]-3-keto-4,6-dimethyl-phenoxazine-1,9-dicarboxamide > InChI=1S/C36H50N8O10/c1-13(2)22(38-9)34(51)44-36(53)25(18(8)46)43-32(49)20-21(37)28(47)16(6)30-27(20)40-26-19(12-11-15(5)29(26)54-30)31(48)42-24(17(7)45)35(52)41-23(14(3)4)33(50)39-10/h11-14,17-18,22-25,38,45-46H,37H2,1-10H3,(H,39,50)(H,41,52)(H,42,48)(H,43,49)(H,44,51,53) > UZRMVJRWYQQNQU-UHFFFAOYSA-N > 0.8 > 754.36498982 > C36H50N8O10 > 754.8 > CC1=C2C(=C(C=C1)C(=O)NC(C(C)O)C(=O)NC(C(C)C)C(=O)NC)N=C3C(=C(C(=O)C(=C3O2)C)N)C(=O)NC(C(C)O)C(=O)NC(=O)C(C(C)C)NC > CC1=C2C(=C(C=C1)C(=O)NC(C(C)O)C(=O)NC(C(C)C)C(=O)NC)N=C3C(=C(C(=O)C(=C3O2)C)N)C(=O)NC(C(C)O)C(=O)NC(=O)C(C(C)C)NC > 280 > 754.36498982 > 0 > 54 > 0 > 6 > 0 > 0 > 0 > 1 > 1000 > 1 5 255 > 1 38 8 1 39 8 16 31 8 16 33 8 19 20 3 24 2 3 21 25 3 23 22 3 28 41 3 31 34 8 31 39 8 33 35 8 34 47 8 35 46 8 38 44 8 39 45 8 30 4 3 44 48 8 45 50 8 46 48 8 47 50 8 $$$$