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25 28 1 0 0 0 0 26 27 1 0 0 0 0 27 24 1 0 0 0 0 28 29 1 0 0 0 0 29 24 1 0 0 0 0 26 25 1 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 33 30 1 0 0 0 0 34 35 1 0 0 0 0 35 30 1 0 0 0 0 32 31 1 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 39 36 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 38 37 1 0 0 0 0 43 46 1 0 0 0 0 44 45 1 0 0 0 0 45 42 1 0 0 0 0 46 47 1 0 0 0 0 47 42 1 0 0 0 0 44 43 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 51 48 1 0 0 0 0 52 53 1 0 0 0 0 53 48 1 0 0 0 0 50 49 1 0 0 0 0 55 58 1 0 0 0 0 56 57 1 0 0 0 0 57 54 1 0 0 0 0 58 59 1 0 0 0 0 59 54 1 0 0 0 0 56 55 1 0 0 0 0 66 60 1 0 0 0 0 67 61 1 0 0 0 0 68 66 2 0 0 0 0 69 62 1 0 0 0 0 70 67 1 0 0 0 0 71 64 2 0 0 0 0 72 65 2 0 0 0 0 73 70 1 0 0 0 0 74 73 2 0 0 0 0 75 63 1 0 0 0 0 76 73 1 0 0 0 0 65 62 1 0 0 0 0 68 67 1 0 0 0 0 61 60 2 0 0 0 0 62 64 1 0 0 0 0 63 60 1 0 0 0 0 64 63 1 0 0 0 0 65 61 1 0 0 0 0 83 77 1 0 0 0 0 84 78 1 0 0 0 0 85 83 2 0 0 0 0 86 79 1 0 0 0 0 87 84 1 0 0 0 0 88 81 2 0 0 0 0 89 82 2 0 0 0 0 90 87 1 0 0 0 0 91 90 2 0 0 0 0 92 80 1 0 0 0 0 93 90 1 0 0 0 0 82 79 1 0 0 0 0 85 84 1 0 0 0 0 78 77 2 0 0 0 0 79 81 1 0 0 0 0 80 77 1 0 0 0 0 81 80 1 0 0 0 0 82 78 1 0 0 0 0 100 94 1 0 0 0 0 101 95 1 0 0 0 0 102100 2 0 0 0 0 103 96 1 0 0 0 0 104101 1 0 0 0 0 105 98 2 0 0 0 0 106 99 2 0 0 0 0 107104 1 0 0 0 0 108107 2 0 0 0 0 109 97 1 0 0 0 0 110107 1 0 0 0 0 99 96 1 0 0 0 0 102101 1 0 0 0 0 95 94 2 0 0 0 0 96 98 1 0 0 0 0 97 94 1 0 0 0 0 98 97 1 0 0 0 0 99 95 1 0 0 0 0 117111 1 0 0 0 0 118112 1 0 0 0 0 119117 2 0 0 0 0 120113 1 0 0 0 0 121118 1 0 0 0 0 122115 2 0 0 0 0 123116 2 0 0 0 0 124121 1 0 0 0 0 125124 2 0 0 0 0 126114 1 0 0 0 0 127124 1 0 0 0 0 116113 1 0 0 0 0 119118 1 0 0 0 0 112111 2 0 0 0 0 113115 1 0 0 0 0 114111 1 0 0 0 0 115114 1 0 0 0 0 116112 1 0 0 0 0 134128 1 0 0 0 0 135129 1 0 0 0 0 136134 2 0 0 0 0 137130 1 0 0 0 0 138135 1 0 0 0 0 139132 2 0 0 0 0 140133 2 0 0 0 0 141138 1 0 0 0 0 142141 2 0 0 0 0 143131 1 0 0 0 0 144141 1 0 0 0 0 133130 1 0 0 0 0 136135 1 0 0 0 0 129128 2 0 0 0 0 130132 1 0 0 0 0 131128 1 0 0 0 0 132131 1 0 0 0 0 133129 1 0 0 0 0 151145 1 0 0 0 0 152146 1 0 0 0 0 153151 2 0 0 0 0 154147 1 0 0 0 0 155152 1 0 0 0 0 156149 2 0 0 0 0 157150 2 0 0 0 0 158155 1 0 0 0 0 159158 2 0 0 0 0 160148 1 0 0 0 0 161158 1 0 0 0 0 150147 1 0 0 0 0 153152 1 0 0 0 0 146145 2 0 0 0 0 147149 1 0 0 0 0 148145 1 0 0 0 0 149148 1 0 0 0 0 150146 1 0 0 0 0 168162 1 0 0 0 0 169163 1 0 0 0 0 170168 2 0 0 0 0 171164 1 0 0 0 0 172169 1 0 0 0 0 173166 2 0 0 0 0 174167 2 0 0 0 0 175172 1 0 0 0 0 176175 2 0 0 0 0 177165 1 0 0 0 0 178175 1 0 0 0 0 167164 1 0 0 0 0 170169 1 0 0 0 0 163162 2 0 0 0 0 164166 1 0 0 0 0 165162 1 0 0 0 0 166165 1 0 0 0 0 167163 1 0 0 0 0 M END > DBSALT002522 > drugbank > C1CNCCN1.C1CNCCN1.C1CNCCN1.C1CNCCN1.C1CNCCN1.C1CNCCN1.C1CNCCN1.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O.CN1C2=C(N(CC(O)=O)C=N2)C(=O)N(C)C1=O > InChI=1S/8C9H10N4O4.7C4H10N2/c8*1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15;7*1-2-6-4-3-5-1/h8*4H,3H2,1-2H3,(H,14,15);7*5-6H,1-4H2 > IUKJNIOSXCPLLP-UHFFFAOYSA-N > C100H150N46O32 > 2508.59 > 2507.152426854 > 5 > 328 > -0.9998171252910432 > 21.96009914618883 > 0 > 1 > 0 > 0 > octakis(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)acetic acid); heptakis(piperazine) > -0.80 > -1.0676622833333338 > -1.21 > 1 > -1 > 23 > -1 > 3.2622646839458302 > -1.0357759017948838 > 95.74000000000001 > 55.915800000000004 > 16 > 0 > 1.47e+01 g/l > benzoxonium chloride > 0 > DBSALT002522 > Acefylline piperazine > DB13573 > Acefylline > 18833-13-1 > 12I91IOS6Z $$$$