0 B11R0.6 C=C(C)CCOC(=O)C=C(C)C CNP0172125.0 [0,0,0,0,0,0|1,0,3]=4 1 B11R0.6 C=C(C)CCOC(=O)CC(=C)C CNP0386732.0 [0,0,0,0,0,0|1,0,2]=3 2 B11R0.6 C=C(C)CCOC(=O)CC(C)C CNP0147789.0 [0,0,0,0,0,0|1,0,3]=4 3 B11R0.6 CC(=CC(=O)OCCC(C)C)C CNP0302991.0 [0,0,0,0,0,0|1,0,1]=2 4 B11R0.6 CC(=CCOC(=O)C=C(C)C)C CNP0350613.0 [0,0,0,0,0,0|1,0,3]=4 5 B11R0.6 CC(=CCOC(=O)CC(C)C)C CNP0115393.0 [0,0,0,0,0,0|1,0,3]=4 6 B11R0.6 CC(=O)CC(=CCC=C(C)C)C CNP0372207.0 [0,0,0,0,0,0|2,0,2]=4 7 B11R0.6 CC(=O)CC(=O)OCCC(C)C CNP0002893.0 [0,0,0,0,0,0|0,0,0]=0 8 B11R0.6 CC(=O)OC(C)CCCC(C)C CNP0003322.0 [0,0,0,0,0,0|3,0,1]=4 9 B11R0.6 CC(C)CCOC(=O)CC(C)C CNP0335578.0 [0,0,0,0,0,0|1,0,1]=2 10 B10R0.3 C=C(C)CCOC(=O)CCC CNP0525083.0 [1,0,0,0,0,0|0,0,3]=4 11 B10R0.3 CCCC(=O)OCCC(C)C CNP0144794.0 [1,0,0,0,0,0|0,0,1]=2 12 B10R0.3 CCOC(=O)CCCC(C)C CNP0181211.0 [1,0,0,0,0,0|2,0,1]=4 13 B10R0.3 COCC(=O)NCCC(C)C CNP0213339.0 [1,0,0,0,0,0|2,0,0]=3 14 B10R0.6 CCCCCC(=O)C=C(C)C CNP0610551.0 [1,0,0,0,0,0|2,0,1]=4 15 B10R0.6 CCCCCC(=O)CC(=O)O CNP0414310.0 [1,0,0,0,0,0|2,0,0]=3 16 B10R0.6 CCCCOC(=O)CC(=O)C CNP0002486.0 [1,0,0,0,0,0|0,0,0]=1 17 B10R0.6 CCCCOC(=O)CC(C)C CNP0084165.0 [1,0,0,0,0,0|1,0,1]=3 18 B10R0.6 CCCCOC(=O)C[C@@H](C)O CNP0226564.2 [1,0,0,0,0,0|0,0,2]=3 19 B10R0.6 CCCCOC(=O)C[C@H](C)O CNP0226564.1 [1,0,0,0,0,0|0,0,2]=3 20 B10R0.6 CCCCOC(=O)NC(=O)N CNP0536572.0 [1,0,0,0,0,0|2,0,0]=3 21 B10R0.6 COCCOC(=O)C[C@@H](C)O CNP0205160.1 [1,0,0,0,0,0|1,0,2]=4 22 B10R0.97 CC(=O)CCCCCC(C)C CNP0576266.0 [1,0,0,0,0,0|1,0,1]=3 23 B10R0.97 CC(C)CCCCCC(=O)O CNP0505737.0 [1,0,0,0,0,0|2,0,1]=4 24 B12R0.66 CC(=CC(=O)OCC[N+](C)(C)C)C CNP0036955.0 [0,1,0,0,0,0|2,0,1]=4 25 B12R0.241 CC[C@H](C)CCOC(=O)CC(C)C CNP0310686.1 [0,1,0,0,0,0|1,0,1]=3 26 B12R0.686 C=C(C(=O)OCCC(C)C)[C@H](C)O CNP0309731.1 [0,1,0,0,0,0|0,0,3]=4 27 B12R0.687 CC(C)CC(=O)NC[C@@H](O)C(C)C CNP0293063.1 [0,1,0,0,0,0|2,0,1]=4 28 B12R1.101 C[C@@H](O)C[C@@H]1C[C@@H](CC(=O)O1)O CNP0233374.2 [0,0,0,1,0,0|1,0,2]=4 29 B12R1.101 C[C@H](O)C[C@@H]1C[C@@H](CC(=O)O1)O CNP0233374.1 [0,0,0,1,0,0|1,0,2]=4 30 B12R1.101 C[C@H](O)C[C@H]1C[C@@H](CC(=O)O1)O CNP0233374.3 [0,0,0,1,0,0|1,0,2]=4 31 B12R1.498 CC(=O)[C@@H]1[C@@H](CC[C@@H]1C(C)C)C CNP0068597.3 [0,0,0,1,0,0|2,0,1]=4 32 B12R1.498 CC(=O)[C@@H]1[C@@H](CC[C@H]1C(C)C)C CNP0068597.1 [0,0,0,1,0,0|2,0,1]=4 33 B12R1.498 CC(=O)[C@@H]1[C@H](CC[C@H]1C(C)C)C CNP0068597.4 [0,0,0,1,0,0|2,0,1]=4 34 B12R1.498 CC(=O)[C@H]1[C@H](CC[C@@H]1C)C(C)C CNP0068597.2 [0,0,0,1,0,0|2,0,1]=4 35 B10R0.96 CC(=O)CC(=O)CCC(=O)O CNP0178580.0 [0,0,0,0,1,0|2,0,1]=4 36 B10R0.96 CC(=O)CC(=O)OCC(C)C CNP0066978.0 [0,0,0,0,1,0|0,0,0]=1 37 B10R0.96 CC(C)CNC(=O)CC(C)C CNP0439722.0 [0,0,0,0,1,0|2,0,1]=4 38 B10R0.96 CC(C)COC(=O)CC(C)C CNP0361085.0 [0,0,0,0,1,0|1,0,1]=3 39 B10R0.98 CC(=O)C(=O)OCCC(C)C CNP0002700.0 [0,0,0,0,1,0|0,0,0]=1 40 B10R0.98 CC(C)CCOC(=O)C(C)C CNP0252990.0 [0,0,0,0,1,0|1,0,1]=3 41 B10R0.98 CC(C)CCOC(=O)C(C)O CNP0486512.0 [0,0,0,0,1,0|0,0,2]=3 42 B12R0.44 CC(C)CCCC(=O)CCC(C)C CNP0268061.0 [0,0,0,0,0,1|2,0,1]=4 43 B12R0.44 CC(C)CCNC(=O)CCC(C)C CNP0435204.0 [0,0,0,0,0,1|2,0,1]=4 44 B12R0.44 CC(C)CCOC(=O)CCC(C)C CNP0314746.0 [0,0,0,0,0,1|1,0,1]=3 45 B12R0.270 CC(C)CCCOC(=O)CC(C)C CNP0076997.0 [0,0,0,0,0,1|1,0,1]=3 46 B9R0.1 CC(=CCCC(C)C)C=O CNP0199233.0 [2,0,0,0,0,0|2,0,0]=4 47 B9R0.1 CCC(=O)C=CCC(C)C CNP0303308.0 [2,0,0,0,0,0|1,0,1]=4 48 B9R0.1 CCC(=O)OCCC(C)C CNP0244888.0 [2,0,0,0,0,0|0,0,0]=2 49 B9R0.1 COC(=O)CCCC(C)C CNP0354056.0 [2,0,0,0,0,0|2,0,0]=4 50 B9R0.2 CC(C)CCCCCC=O CNP0541884.0 [2,0,0,0,0,0|1,0,1]=4 51 B9R0.2 CCCCC=CCC(=O)O CNP0229088.0 [2,0,0,0,0,0|2,0,0]=4 52 B9R0.2 CCCCC=COC(=O)C CNP0481499.0 [2,0,0,0,0,0|2,0,0]=4 53 B9R0.2 CCCCCC=CC(=O)C CNP0269922.0 [2,0,0,0,0,0|1,0,1]=4 54 B9R0.2 CCCCCCCC(=O)C CNP0364677.0 [2,0,0,0,0,0|1,0,1]=4 55 B9R0.2 CCCCOCCC(=O)O CNP0103655.0 [2,0,0,0,0,0|1,0,1]=4 56 B9R0.5 C=CCC(=O)CCCCC CNP0108996.0 [2,0,0,0,0,0|1,0,1]=4 57 B9R0.5 CC=CC(=O)CCCCC CNP0176491.0 [2,0,0,0,0,0|1,0,1]=4 58 B9R0.5 CC=CC(=O)OCCCC CNP0017670.0 [2,0,0,0,0,0|0,0,1]=3 59 B9R0.5 CCCCCC(=O)CCC CNP0331420.0 [2,0,0,0,0,0|1,0,1]=4 60 B9R0.5 CCCCOC(=O)CCC CNP0123594.0 [2,0,0,0,0,0|0,0,1]=3 61 B9R0.4 CCCCC(=O)C=C(C)C CNP0611962.0 [2,0,0,0,0,0|1,0,1]=4 62 B9R0.4 CCCCC(=O)CC(=O)C CNP0579463.0 [2,0,0,0,0,0|0,0,0]=2 63 B9R0.4 CCCOC(=O)CC(=O)O CNP0488661.0 [2,0,0,0,0,0|1,0,0]=3 64 B9R0.4 CCCOC(=O)CC(C)C CNP0105828.0 [2,0,0,0,0,0|1,0,1]=4 65 B9R0.4 CCCOC(=O)NC(=O)N CNP0233110.0 [2,0,0,0,0,0|2,0,0]=4 66 B11R0.145 CC=C(C)C(=O)OCCC(C)C CNP0234140.0 [1,1,0,0,0,0|0,0,1]=3 67 B11R0.145 CC[C@@H](C)C(=O)OCCC(C)C CNP0330262.1 [1,1,0,0,0,0|0,0,1]=3 68 B11R0.147 CCCCC(=O)OCCC(C)C CNP0141436.0 [1,1,0,0,0,0|0,0,1]=3 69 B11R0.174 CCCC(=O)OCCC(C)CC CNP0235877.0 [1,1,0,0,0,0|0,0,1]=3 70 B11R0.180 CCCC(=O)OCC[N+](C)(C)C CNP0549253.0 [1,1,0,0,0,0|1,0,1]=4 71 B11R0.180 CCCC(=O)OCC[N+](C)(C)C CNP0602327.0 [1,1,0,0,0,0|1,0,1]=4 72 B11R0.2 CCCCCOC(=O)CC(C)C CNP0135492.0 [1,1,0,0,0,0|1,0,1]=4 73 B11R0.107 CCC(C)COC(=O)C=C(C)C CNP0003238.0 [1,1,0,0,0,0|1,0,1]=4 74 B11R0.107 CCC(C)COC(=O)CC(C)C CNP0079769.0 [1,1,0,0,0,0|1,0,1]=4 75 B11R0.139 CCCCCC(=O)C(C)C(=O)C CNP0003046.0 [1,1,0,0,0,0|1,0,0]=3 76 B11R0.93 CSC(C)CC(=O)OCC(C)C CNP0003257.0 [0,1,0,0,1,0|0,1,1]=4 77 B11R0.109 C=C(C)C(=O)OCCC(C)CC CNP0502896.0 [0,1,0,0,1,0|1,0,0]=3 78 B11R0.109 CCC(C)CCOC(=O)C(C)C CNP0592735.0 [0,1,0,0,1,0|1,0,1]=4 79 B13R0.198 CCC(C)CCCOC(=O)CC(C)C CNP0505445.0 [0,1,0,0,0,1|1,0,1]=4 80 B11R1.157 C[C@H](O)C[C@H]1CC=CC(=O)O1 CNP0256359.1 [1,0,0,1,0,0|1,0,1]=4 81 B11R1.166 CC1=CC[C@H](C(=O)C1)C(C)C CNP0354398.1 [1,0,0,1,0,0|2,0,0]=4 82 B11R1.424 CC1=CCCC(C1C=O)(C)C CNP0173915.0 [1,0,0,1,0,0|2,0,0]=4 83 B11R1.563 C[C@@H]1CCO[C@H](CC(=O)C1)O CNP0173979.1 [1,0,0,1,0,0|0,0,2]=4 84 B11R1.34 CCC[C@@H]1C[C@@H](CC(=O)O1)O CNP0210234.1 [1,0,0,1,0,0|0,0,2]=4 85 B11R1.471 CC(=O)C1C(=O)OCC1CO CNP0341196.0 [1,0,0,1,0,0|1,0,0]=3 86 B11R1.177 CC(=O)C1CCCCC1(C)C CNP0573229.0 [1,0,0,1,0,0|1,0,1]=4 87 B11R1.922 CC(=O)/C=C/[C@@H]1CCC1(C)C CNP0308981.1 [1,0,0,1,0,0|1,0,1]=4 88 B11R1.74 CC1=CC(=O)CC(C1)C(C)C CNP0270583.0 [0,0,0,1,1,0|1,0,1]=4 89 B11R1.1040 C[C@@H](O)[C@@H]1C(=O)OCC1(C)C CNP0546702.1 [0,0,0,1,1,0|0,0,2]=4 90 B11R1.21 C=C1CC[C@@H](CC1=O)C(C)C CNP0243861.1 [0,0,0,1,1,0|2,0,0]=4 91 B11R1.21 CC1=CC[C@@H](CC1=O)C(C)C CNP0402519.1 [0,0,0,1,1,0|2,0,0]=4 92 B11R1.21 CC1=CC[C@H](CC1=O)C(C)C CNP0402519.2 [0,0,0,1,1,0|2,0,0]=4 93 B11R1.80 CC(C)C[C@H]1C[C@@H](C(=O)O1)O CNP0356426.1 [0,0,0,1,1,0|0,0,2]=4 94 B13R1.2814 CC(=O)[C@@H]1C(=O)C=C(CC1(C)C)C CNP0349921.1 [0,1,0,1,0,0|1,0,1]=4 95 B13R1.3467 CC(C)CC[C@H]1C(=O)C[C@@H](C1=O)C CNP0501745.1 [0,1,0,1,0,0|1,0,1]=4 96 B9R0.48 CC=CC(=O)OCC(C)C CNP0002921.0 [1,0,0,0,1,0|0,0,1]=3 97 B9R0.48 CCCC(=O)NCC(C)C CNP0405550.0 [1,0,0,0,1,0|1,0,1]=4 98 B9R0.48 CCCC(=O)OCC(C)C CNP0134371.0 [1,0,0,0,1,0|0,0,1]=3 99 B9R0.48 CCOC(=O)CCC(C)C CNP0084329.0 [1,0,0,0,1,0|1,0,1]=4 100 B9R0.47 C=C(C)C(=O)OCCCC CNP0245815.0 [1,0,0,0,1,0|1,0,0]=3 101 B9R0.47 C=C(CCCCC)C(=O)C CNP0237498.0 [1,0,0,0,1,0|2,0,0]=4 102 B9R0.47 CCCCCC(=O)C(=O)C CNP0172779.0 [1,0,0,0,1,0|1,0,0]=3 103 B9R0.47 CCCCOC(=O)C(C)C CNP0252598.0 [1,0,0,0,1,0|1,0,1]=4 104 B9R0.47 CCCCOC(=O)[C@H](C)O CNP0002502.1 [1,0,0,0,1,0|0,0,2]=4 105 B9R0.55 CC(=O)C=CCCC(C)C CNP0019322.0 [1,0,0,0,1,0|0,0,1]=3 106 B9R0.55 CC(=O)CCCCC(C)C CNP0596169.0 [1,0,0,0,1,0|0,0,1]=3 107 B9R0.55 CC(C)CCCCC(=O)N CNP0291155.0 [1,0,0,0,1,0|1,0,1]=4 108 B9R0.55 CC(C)CCCCC(=O)O CNP0196819.0 [1,0,0,0,1,0|1,0,1]=4 109 B9R0.7 C=C(C)C(=O)OCC(C)C CNP0097521.0 [0,0,0,0,2,0|1,0,0]=3 110 B9R0.7 CC(C)COC(=O)C(C)C CNP0146650.0 [0,0,0,0,2,0|1,0,1]=4 111 B9R0.53 CC(=CC(=O)OC(C)C)C CNP0228790.0 [0,0,0,0,2,0|1,0,1]=4 112 B9R0.53 CC(=O)C[C@@H](C)CC(C)C CNP0357030.1 [0,0,0,0,2,0|1,0,1]=4 113 B9R0.53 CC(C)CC(=O)CC(C)C CNP0084478.0 [0,0,0,0,2,0|1,0,1]=4 114 B9R0.53 CC(C)CC(=O)OC(C)C CNP0311912.0 [0,0,0,0,2,0|1,0,1]=4 115 B9R0.53 C[C@H](N)CC(=O)CC(=O)O CNP0136260.1 [0,0,0,0,2,0|2,0,0]=4 116 B11R0.176 CCCC(=O)OCCCC(C)C CNP0508013.0 [1,0,0,0,0,1|0,0,1]=3 117 B11R0.46 CCCCCC(=O)CCC(=O)C CNP0136880.0 [1,0,0,0,0,1|1,0,0]=3 118 B11R0.46 CCCCCC(=O)CCC(=O)O CNP0235547.0 [1,0,0,0,0,1|2,0,0]=4 119 B11R0.46 CCCCCC(=O)NCC(=O)O CNP0098252.0 [1,0,0,0,0,1|2,0,0]=4 120 B11R0.46 CCCCOC(=O)CCC(=O)C CNP0349279.0 [1,0,0,0,0,1|0,0,0]=2 121 B11R0.46 CCCCOC(=O)CCC(=O)O CNP0348497.0 [1,0,0,0,0,1|1,0,0]=3 122 B11R0.30 CC(=O)CCCCCCC(C)C CNP0511068.0 [1,0,0,0,0,1|1,0,1]=4 123 B13R0.182 CC(C)CCCOC(=O)CCC(C)C CNP0192089.0 [0,0,0,0,0,2|1,0,1]=4