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0 78 79 1 0 0 0 0 78 80 1 0 0 0 0 78184 1 0 0 0 0 80 84 1 0 0 0 0 80185 1 0 0 0 0 80186 1 0 0 0 0 81 90 1 0 0 0 0 81187 1 0 0 0 0 81188 1 0 0 0 0 82189 1 0 0 0 0 82190 1 0 0 0 0 82191 1 0 0 0 0 84 88 1 0 0 0 0 84 89 1 0 0 0 0 84192 1 0 0 0 0 85 92 2 0 0 0 0 85 93 1 0 0 0 0 86 87 1 0 0 0 0 86 91 1 0 0 0 0 86194 1 0 0 0 0 88195 1 0 0 0 0 88196 1 0 0 0 0 88197 1 0 0 0 0 89198 1 0 0 0 0 89199 1 0 0 0 0 89200 1 0 0 0 0 91 94 1 0 0 0 0 91201 1 0 0 0 0 91202 1 0 0 0 0 92 97 1 0 0 0 0 92203 1 0 0 0 0 93 98 2 0 0 0 0 93204 1 0 0 0 0 94 95 1 0 0 0 0 94100 2 0 0 0 0 95102 1 0 0 0 0 95104 2 0 0 0 0 96 99 1 0 0 0 0 96103 1 0 0 0 0 96207 1 0 0 0 0 97101 2 0 0 0 0 97208 1 0 0 0 0 98101 1 0 0 0 0 98209 1 0 0 0 0 100212 1 0 0 0 0 102105 2 0 0 0 0 103106 1 0 0 0 0 103213 1 0 0 0 0 103214 1 0 0 0 0 104109 1 0 0 0 0 104217 1 0 0 0 0 105111 1 0 0 0 0 105218 1 0 0 0 0 106113 2 0 0 0 0 107108 1 0 0 0 0 107110 1 0 0 0 0 107219 1 0 0 0 0 109111 2 0 0 0 0 109220 1 0 0 0 0 110112 1 0 0 0 0 110221 1 0 0 0 0 110222 1 0 0 0 0 111223 1 0 0 0 0 112114 1 0 0 0 0 112115 2 0 0 0 0 113226 1 0 0 0 0 114116 1 0 0 0 0 114118 2 0 0 0 0 115229 1 0 0 0 0 116119 2 0 0 0 0 117230 1 0 0 0 0 118120 1 0 0 0 0 118232 1 0 0 0 0 119121 1 0 0 0 0 119233 1 0 0 0 0 120121 2 0 0 0 0 120234 1 0 0 0 0 121235 1 0 0 0 0 M END > 16130931 > 1 > 3580 > 22 > 19 > 48 > AAADcfB//gBAAAAAAAAAAAAAAAAAAWLFixYwYMAAAAAAAFgB/gAAHgQQCAAADSzF3gS/3vfJkgqoAzX3fEDCgC2xMrAJ2aG+fJiKbvLi2bOUcAhs1hPY2Cecy+COoAAAAAACAABAAAAAAAQAAAAAAAAAAA== > 2-[[(2S)-2-[[(2S)-1-[(2S)-5-amino-2-[[2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-5-oxo-pentanoyl]amino]-4-methyl-pentanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-5-oxo-pentanoyl]pyrrolidine-2-carbonyl]amino]-4-methylsulfinyl-butanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid > 2-[[(2S)-2-[[[(2S)-1-[(2S)-5-amino-2-[[2-[[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]-3-(1H-indol-3-yl)-1-oxopropyl]amino]-4-methyl-1-oxopentyl]amino]-1,5-dioxopentyl]amino]-4-methyl-1-oxopentyl]amino]-1-oxohexyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-oxoethyl]amino]-1,5-dioxopentyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-methylsulfinyl-1-oxobutyl]amino]-3-(4-hydroxyphenyl)propanoic acid > 2-[[(2S)-2-[[(2S)-1-[(2S)-5-amino-2-[[2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]-4-methylsulfinylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid > 2-[[(2S)-2-[[(2S)-1-[(2S)-5-amino-2-[[2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]-4-methylsulfinylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid > 2-[[(2S)-2-[[(2S)-1-[(2S)-5-azanyl-2-[2-[[(2S)-1-[(2S)-6-azanyl-2-[[(2S)-2-[[(2S)-5-azanyl-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-5-oxidanylidene-pentanoyl]amino]-4-methyl-pentanoyl]amino]hexanoyl]pyrrolidin-2-yl]carbonylamino]ethanoylamino]-5-oxidanylidene-pentanoyl]pyrrolidin-2-yl]carbonylamino]-4-methylsulfinyl-butanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid > 2-[[(2S)-2-[[(2S)-1-[(2S)-5-amino-2-[[2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-5-keto-pentanoyl]amino]-4-methyl-pentanoyl]amino]hexanoyl]prolyl]amino]acetyl]amino]-5-keto-pentanoyl]prolyl]amino]-4-methylsulfinyl-butanoyl]amino]-3-(4-hydroxyphenyl)propionic acid > InChI=1S/C82H114N20O18S/c1-45(2)34-61(98-76(112)63(38-49-41-89-56-17-9-7-15-53(49)56)99-77(113)64(39-50-42-87-44-91-50)96-71(107)54(84)37-48-40-88-55-16-8-6-14-52(48)55)74(110)93-57(25-27-68(85)104)72(108)97-62(35-46(3)4)75(111)95-59(18-10-11-30-83)80(116)101-31-12-19-66(101)78(114)90-43-70(106)92-60(26-28-69(86)105)81(117)102-32-13-20-67(102)79(115)94-58(29-33-121(5)120)73(109)100-65(82(118)119)36-47-21-23-51(103)24-22-47/h6-9,14-17,21-24,40-42,44-46,54,57-67,88-89,103H,10-13,18-20,25-39,43,83-84H2,1-5H3,(H2,85,104)(H2,86,105)(H,87,91)(H,90,114)(H,92,106)(H,93,110)(H,94,115)(H,95,111)(H,96,107)(H,97,108)(H,98,112)(H,99,113)(H,100,109)(H,118,119)/t54-,57-,58-,59-,60-,61-,62-,63?,64-,65?,66-,67-,121?/m0/s1 > SKEFKEOTNIPLCQ-LWIQTABASA-N > -2.2 > 1698.83406804 > C82H114N20O18S > 1700.0 > CC(C)CC(C(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)NCC(=O)NC(CCC(=O)N)C(=O)N2CCCC2C(=O)NC(CCS(=O)C)C(=O)NC(CC3=CC=C(C=C3)O)C(=O)O)NC(=O)C(CCC(=O)N)NC(=O)C(CC(C)C)NC(=O)C(CC4=CNC5=CC=CC=C54)NC(=O)C(CC6=CN=CN6)NC(=O)C(CC7=CNC8=CC=CC=C87)N > CC(C)C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCC(=O)N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCS(=O)C)C(=O)NC(CC3=CC=C(C=C3)O)C(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)C(CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CC6=CN=CN6)NC(=O)[C@H](CC7=CNC8=CC=CC=C87)N > 624 > 1698.83406804 > 0 > 121 > 10 > 3 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 82 3 102 105 8 104 109 8 105 111 8 106 113 8 109 111 8 112 114 8 112 115 8 114 116 8 114 118 8 116 119 8 118 120 8 119 121 8 120 121 8 49 22 5 57 24 5 52 25 5 59 26 5 74 29 6 78 31 6 34 100 8 34 102 8 96 35 5 36 106 8 36 117 8 107 37 6 38 115 8 38 116 8 39 113 8 39 117 8 40 51 6 41 53 5 75 77 3 85 92 8 85 93 8 86 91 3 92 97 8 93 98 8 94 100 8 94 95 8 95 102 8 95 104 8 97 101 8 98 101 8 $$$$