0 B14R0.394 C#CCCCCCCCCCCC(=O)C CNP0503056.0 [0,0,0,0,0,0|2,0,2]=4 1 B14R0.394 C=CCCCCCCCCCOC(=O)C CNP0003547.0 [0,0,0,0,0,0|3,0,1]=4 2 B14R0.394 CC(C)CCCCCCCC=CCC#N CNP0071940.0 [0,0,0,0,0,0|1,0,3]=4 3 B14R0.394 CC(C)CCCCCCCCCCC=O CNP0178223.0 [0,0,0,0,0,0|0,0,0]=0 4 B14R0.394 CC(C)CCCCCCCCCCCN CNP0301011.0 [0,0,0,0,0,0|1,0,1]=2 5 B14R0.394 CC=CCCCCCC=CCCC(C)C CNP0205820.0 [0,0,0,0,0,0|1,0,3]=4 6 B14R0.394 CCCCCCCCCCCCC(=O)C CNP0420877.0 [0,0,0,0,0,0|2,0,2]=4 7 B14R0.394 CCCCCCCCCCCCC(C)C CNP0391491.0 [0,0,0,0,0,0|1,0,1]=2 8 B14R0.394 CCCCCCCCCCCCC(C)O CNP0214390.0 [0,0,0,0,0,0|2,0,1]=3 9 B14R0.394 CCCCCCCCCCCCN(C)C CNP0476829.0 [0,0,0,0,0,0|2,0,1]=3 10 B13R0.54 C=C(C)CCCCCCCCCCC CNP0076867.0 [1,0,0,0,0,0|0,0,3]=4 11 B13R0.54 C=CCCCCCCCCCC(=O)C CNP0306240.0 [1,0,0,0,0,0|1,0,2]=4 12 B13R0.54 CC(=O)OCCCCCCCCC=O CNP0547492.0 [1,0,0,0,0,0|2,0,1]=4 13 B13R0.54 CC(C)CCCCCCCCCCO CNP0498996.0 [1,0,0,0,0,0|0,0,1]=2 14 B13R0.54 CCCCCCCCCCCC(=O)C CNP0221288.0 [1,0,0,0,0,0|1,0,2]=4 15 B13R0.54 CCCCCCCCCCCC(C)C CNP0149200.0 [1,0,0,0,0,0|0,0,1]=2 16 B13R0.54 CCCCCCCCCCC[C@@H](C)O CNP0149423.2 [1,0,0,0,0,0|1,0,1]=3 17 B13R0.54 CCCCCCCCCCC[C@H](C)O CNP0149423.1 [1,0,0,0,0,0|1,0,1]=3 18 B13R0.54 O=CCCCCCCCCCC(=O)O CNP0102682.0 [1,0,0,0,0,0|2,0,1]=4 19 B13R0.336 C#CCCCCCCCCCCCC CNP0579427.0 [1,0,0,0,0,0|1,0,1]=3 20 B13R0.336 C=CCCCCCCC=CCCCC CNP0527141.0 [1,0,0,0,0,0|1,0,2]=4 21 B13R0.336 C=CCCCCCCCCCCC=C CNP0252871.0 [1,0,0,0,0,0|1,0,2]=4 22 B13R0.336 C=CCCCCCCCCCCCC CNP0137398.0 [1,0,0,0,0,0|1,0,0]=2 23 B13R0.336 C=CCNCCCCCCCCCC CNP0522683.0 [1,0,0,0,0,0|2,0,0]=3 24 B13R0.336 CC=CCCCCCCCCCCC CNP0269313.0 [1,0,0,0,0,0|1,0,1]=3 25 B13R0.336 CC=CCCCCCCCCCCO CNP0151348.0 [1,0,0,0,0,0|2,0,1]=4 26 B13R0.336 CCCCCCCCC=CCCC=O CNP0003281.0 [1,0,0,0,0,0|0,0,2]=3 27 B13R0.336 CCCCCCCCCCC=CC=O CNP0146353.0 [1,0,0,0,0,0|0,0,2]=3 28 B13R0.336 CCCCCCCCCCCC=CO CNP0586715.0 [1,0,0,0,0,0|0,0,2]=3 29 B13R0.336 CCCCCCCCCCCC=NO CNP0018714.0 [1,0,0,0,0,0|1,0,2]=4 30 B13R0.336 CCCCCCCCCCCCC#N CNP0226803.0 [1,0,0,0,0,0|1,0,1]=3 31 B13R0.336 CCCCCCCCCCCCC=O CNP0222214.0 [1,0,0,0,0,0|0,0,0]=1 32 B13R0.336 CCCCCCCCCCCCCC CNP0293304.0 [1,0,0,0,0,0|1,0,1]=3 33 B13R0.336 CCCCCCCCCCCCCI CNP0486092.0 [1,0,0,0,0,0|1,0,1]=3 34 B13R0.336 CCCCCCCCCCCCCN CNP0561220.0 [1,0,0,0,0,0|1,0,1]=3 35 B13R0.336 CCCCCCCCCCCCCO CNP0139347.0 [1,0,0,0,0,0|0,0,2]=3 36 B13R0.336 CCCCCCCCCCCOC=O CNP0085671.0 [1,0,0,0,0,0|1,0,0]=2 37 B13R0.336 OCCCCCCCCCCCCBr CNP0591539.0 [1,0,0,0,0,0|1,0,2]=4 38 B13R0.336 OCCCCCCCCCCCCO CNP0172707.0 [1,0,0,0,0,0|1,0,2]=4 39 B15R0.81 CCCCCCCCCCCC[C@@H](C)CC CNP0322318.2 [0,1,0,0,0,0|1,0,1]=3 40 B15R0.81 CCCCCCCCCCCC[C@H](Br)CBr CNP0107528.1 [0,1,0,0,0,0|2,0,1]=4 41 B15R0.81 CCCCCCCCCCCC[C@H](C)CC CNP0322318.1 [0,1,0,0,0,0|1,0,1]=3 42 B15R0.81 CCCCCCCCCCCC[C@H](O)CO CNP0295554.1 [0,1,0,0,0,0|2,0,1]=4 43 B15R0.81 CC[C@H](C)CCCCCCCCCCCN CNP0288451.1 [0,1,0,0,0,0|1,0,1]=3 44 B15R0.81 CC[C@H](C)CCCCCCCCCCCO CNP0193546.1 [0,1,0,0,0,0|0,0,2]=3 45 B15R0.84 C=CCCCCCCCCC[C@@H](O)[C@H](C)N CNP0268996.1 [0,1,0,0,0,0|2,0,0]=3 46 B15R0.84 CCCCCCCCCCC[C@@H](O)[C@H](C)N CNP0291425.1 [0,1,0,0,0,0|2,0,1]=4 47 B15R0.84 CCCCCCCCCCC[C@H](O)[C@@H](C)N CNP0291425.3 [0,1,0,0,0,0|2,0,1]=4 48 B15R0.84 CCCCCCCCCCC[C@H](O)[C@H](C)N CNP0291425.2 [0,1,0,0,0,0|2,0,1]=4 49 B15R0.88 CCCCCCCCCC(C)CCC(C)C CNP0411367.0 [0,1,0,0,0,0|1,0,1]=3 50 B15R0.164 C=CCCCCCCCCCCOC(=O)C CNP0406625.0 [0,1,0,0,0,0|2,0,1]=4 51 B15R0.164 CC(C)CCCCCCCCC=CCC#N CNP0071939.0 [0,1,0,0,0,0|1,0,2]=4 52 B15R0.164 CC(C)CCCCCCCCCCCC#N CNP0071937.0 [0,1,0,0,0,0|1,0,1]=3 53 B15R0.164 CCCCCCCCCCCCCC(C)C CNP0173042.0 [0,1,0,0,0,0|1,0,1]=3 54 B15R0.164 CCCCCCCCCCCCC[C@@H](C)O CNP0286674.1 [0,1,0,0,0,0|2,0,1]=4 55 B15R0.164 CCCCCCCCCCCCC[C@H](C)O CNP0286674.2 [0,1,0,0,0,0|2,0,1]=4 56 B15R0.164 CCCCCCCCCCCCOC(C)C CNP0155066.0 [0,1,0,0,0,0|1,0,1]=3 57 B15R0.164 O=CCCCCCCCCCCCC(=O)O CNP0017740.0 [0,1,0,0,0,0|2,0,1]=4 58 B15R0.222 CC(=O)CCCCCC=CCCCC(C)C CNP0227426.0 [0,1,0,0,0,0|0,0,2]=3 59 B15R0.222 CC(=O)OCCCCCCCCCC(=O)O CNP0256330.0 [0,1,0,0,0,0|2,0,1]=4 60 B15R0.222 CC(C)CCCCC=CCCCCC(=O)O CNP0546962.0 [0,1,0,0,0,0|0,0,2]=3 61 B15R0.222 CC(C)CCCCCCCCCCC(=O)O CNP0189217.0 [0,1,0,0,0,0|0,0,0]=1 62 B15R0.222 CC(C)CCCCCCCCCC[C@H](C)O CNP0353141.1 [0,1,0,0,0,0|0,0,2]=3 63 B15R0.222 NC(=O)CCCCCCCCCCC(=O)N CNP0209978.0 [0,1,0,0,0,0|2,0,1]=4 64 B15R0.222 O=C(O)CCCCCCCCCCC(=O)O CNP0293008.0 [0,1,0,0,0,0|2,0,1]=4 65 B15R0.247 COC(=O)CCCCCCCCCC(C)C CNP0027527.0 [0,1,0,0,0,0|2,0,1]=4 66 B15R0.252 CCCCCCCCCCCC[N+](C)(C)C CNP0590333.0 [0,1,0,0,0,0|2,0,1]=4 67 B15R0.252 CCCCCCCCCCCC[N+](C)(C)[O-] CNP0560879.0 [0,1,0,0,0,0|2,0,1]=4 68 B15R1.856 C[C@H]1CCCCCCCN(C1)CCCN CNP0294689.1 [0,0,0,1,0,0|2,0,1]=4 69 B15R1.5737 C[C@@H]1CCCCCCCCCCC(=O)C1 CNP0104860.1 [0,0,0,1,0,0|0,0,0]=1 70 B15R1.5737 C[C@@H]1CCCCCCCCCCC(=O)O1 CNP0233115.1 [0,0,0,1,0,0|1,0,0]=2 71 B15R1.6595 C[C@H]1CCCCCCCNCCCNC1 CNP0145733.1 [0,0,0,1,0,0|2,0,1]=4 72 B12R0.5 C=CCCCCCCCCCCC CNP0324663.0 [2,0,0,0,0,0|0,0,1]=3 73 B12R0.5 C=CCCCCCCCCCCO CNP0237635.0 [2,0,0,0,0,0|1,0,1]=4 74 B12R0.5 CC=CCCCCCCCCCC CNP0504957.0 [2,0,0,0,0,0|1,0,1]=4 75 B12R0.5 CCC=CCCCCCCCC=O CNP0222286.0 [2,0,0,0,0,0|0,0,2]=4 76 B12R0.5 CCCCC=CCCCCCC=O CNP0318145.0 [2,0,0,0,0,0|0,0,2]=4 77 B12R0.5 CCCCCC=CCCCCC=O CNP0590554.0 [2,0,0,0,0,0|0,0,2]=4 78 B12R0.5 CCCCCCC=CCCCC=O CNP0205630.0 [2,0,0,0,0,0|0,0,2]=4 79 B12R0.5 CCCCCCCCCC=CC=O CNP0141647.0 [2,0,0,0,0,0|0,0,2]=4 80 B12R0.5 CCCCCCCCCCC=CO CNP0086116.0 [2,0,0,0,0,0|0,0,2]=4 81 B12R0.5 CCCCCCCCCCCC#N CNP0071944.0 [2,0,0,0,0,0|1,0,1]=4 82 B12R0.5 CCCCCCCCCCCC=O CNP0211650.0 [2,0,0,0,0,0|0,0,0]=2 83 B12R0.5 CCCCCCCCCCCCC CNP0251262.0 [2,0,0,0,0,0|0,0,1]=3 84 B12R0.5 CCCCCCCCCCCCO CNP0281602.0 [2,0,0,0,0,0|0,0,1]=3 85 B12R0.5 CCCCCCCCCCOC=O CNP0485887.0 [2,0,0,0,0,0|1,0,0]=3 86 B12R0.5 CCCCCCCCCCOCO CNP0587051.0 [2,0,0,0,0,0|1,0,1]=4 87 B12R0.5 CCCCCCCCCOCCC CNP0508454.0 [2,0,0,0,0,0|1,0,1]=4 88 B12R0.5 CCCCCCNCCCCCC CNP0462839.0 [2,0,0,0,0,0|1,0,1]=4 89 B12R0.5 CCCCCCOCCCCCC CNP0492138.0 [2,0,0,0,0,0|1,0,1]=4 90 B12R0.5 OCCCCCCCCCCCO CNP0368503.0 [2,0,0,0,0,0|1,0,1]=4 91 B12R0.234 CCCCCCCCCCC(=O)C CNP0168691.0 [2,0,0,0,0,0|1,0,1]=4 92 B12R0.234 CCCCCCCCCCC(C)C CNP0258052.0 [2,0,0,0,0,0|0,0,0]=2 93 B12R0.234 CCCCCCCCCCC(O)O CNP0076204.0 [2,0,0,0,0,0|2,0,0]=4 94 B12R0.234 CCCCCCCCCC[C@H](C)O CNP0327823.1 [2,0,0,0,0,0|1,0,0]=3 95 B14R0.68 CC(=O)CCCCCCCCCC(=O)O CNP0305653.0 [1,1,0,0,0,0|1,0,1]=4 96 B14R0.68 CC(C)CCCCCCCC=CC(=O)O CNP0304027.0 [1,1,0,0,0,0|0,0,2]=4 97 B14R0.68 CC(C)CCCCCCCCCC(=O)O CNP0314744.0 [1,1,0,0,0,0|0,0,0]=2 98 B14R0.68 CC(C)CCCCCCCCCC(C)O CNP0610273.0 [1,1,0,0,0,0|0,0,1]=3 99 B14R0.68 C[C@H](O)CCCCCCCCCC(=O)O CNP0271260.1 [1,1,0,0,0,0|1,0,0]=3 100 B14R0.88 CCCCCCCCCCC[N+](C)(C)[O-] CNP0557509.0 [1,1,0,0,0,0|1,0,1]=4 101 B14R0.337 C#CCCCCCCCCCC(C)OC CNP0289200.0 [1,1,0,0,0,0|0,0,2]=4 102 B14R0.337 CCCCCCCCCCC[C@H](C)CC CNP0294304.1 [1,1,0,0,0,0|0,0,1]=3 103 B14R0.337 COC(=O)CCCCCCCCCC=O CNP0314293.0 [1,1,0,0,0,0|1,0,1]=4 104 B14R0.344 CCCCCCCCC(C)CCC(C)C CNP0072523.0 [1,1,0,0,0,0|0,0,1]=3 105 B14R0.145 CCCCCCCC(O)CCCCCC CNP0151041.0 [1,1,0,0,0,0|1,0,1]=4 106 B14R0.145 CCCCCCC[C@@H](C)CCCCCC CNP0316250.1 [1,1,0,0,0,0|1,0,1]=4 107 B14R0.145 CCCCCCC[C@H](C)CCCCCC CNP0316250.2 [1,1,0,0,0,0|1,0,1]=4 108 B14R0.179 CCCCCCCC[C@H](O)CCCCO CNP0017921.1 [1,1,0,0,0,0|0,0,2]=4 109 B14R0.392 C#CCCCCCCCCCCCCC CNP0076909.0 [1,1,0,0,0,0|1,0,1]=4 110 B14R0.392 C=CC=CCCCCCCCCCCC CNP0497045.0 [1,1,0,0,0,0|1,0,1]=4 111 B14R0.392 C=CCCCC=CCCCCCCCC CNP0286885.0 [1,1,0,0,0,0|1,0,1]=4 112 B14R0.392 C=CCCCCCC=CCCCCCC CNP0273619.0 [1,1,0,0,0,0|1,0,1]=4 113 B14R0.392 C=CCCCCCCCCCCCC=O CNP0321421.0 [1,1,0,0,0,0|0,0,1]=3 114 B14R0.392 C=CCCCCCCCCCCCCC CNP0103453.0 [1,1,0,0,0,0|1,0,0]=3 115 B14R0.392 CC=CCCCCCCCCCCCC CNP0134200.0 [1,1,0,0,0,0|1,0,0]=3 116 B14R0.392 CC=CCCCCCCCCCCCO CNP0292605.0 [1,1,0,0,0,0|1,0,1]=4 117 B14R0.392 CCC=CCCCCCCCCCC=O CNP0381172.0 [1,1,0,0,0,0|0,0,1]=3 118 B14R0.392 CCC=CCCCCCCCCOC=O CNP0311687.0 [1,1,0,0,0,0|0,0,2]=4 119 B14R0.392 CCCCC=CCCCCCCCC=O CNP0270269.0 [1,1,0,0,0,0|0,0,1]=3 120 B14R0.392 CCCCCCC=CCCCCCC=O CNP0173800.0 [1,1,0,0,0,0|0,0,1]=3 121 B14R0.392 CCCCCCCCC=CCCCC=O CNP0381300.0 [1,1,0,0,0,0|0,0,1]=3 122 B14R0.392 CCCCCCCCCCCC=CC=O CNP0054792.0 [1,1,0,0,0,0|0,0,1]=3 123 B14R0.392 CCCCCCCCCCCC=CCO CNP0358958.0 [1,1,0,0,0,0|0,0,2]=4 124 B14R0.392 CCCCCCCCCCCCC#CO CNP0075343.0 [1,1,0,0,0,0|0,0,2]=4 125 B14R0.392 CCCCCCCCCCCCCC#N CNP0173573.0 [1,1,0,0,0,0|1,0,1]=4 126 B14R0.392 CCCCCCCCCCCCCC=O CNP0200880.0 [1,1,0,0,0,0|0,0,0]=2 127 B14R0.392 CCCCCCCCCCCCCCC CNP0314547.0 [1,1,0,0,0,0|1,0,1]=4 128 B14R0.392 CCCCCCCCCCCCCCCl CNP0509321.0 [1,1,0,0,0,0|1,0,1]=4 129 B14R0.392 CCCCCCCCCCCCCCI CNP0576364.0 [1,1,0,0,0,0|1,0,1]=4 130 B14R0.392 CCCCCCCCCCCCCCN CNP0079841.0 [1,1,0,0,0,0|1,0,1]=4 131 B14R0.392 CCCCCCCCCCCCCCO CNP0209818.0 [1,1,0,0,0,0|0,0,2]=4 132 B14R0.392 CCCCCCCCCCCCCC[11CH3] CNP0480041.0 [1,1,0,0,0,0|1,0,1]=4 133 B14R0.392 CCCCCCCCOCCCCCC CNP0511916.0 [1,1,0,0,0,0|1,0,1]=4 134 B14R0.392 O=CCCCCCCCCCCCC=O CNP0157180.0 [1,1,0,0,0,0|0,0,1]=3 135 B14R0.392 OCCCCCCCCCCCCCO CNP0197941.0 [1,1,0,0,0,0|0,0,2]=4 136 B14R0.393 CCCCCCCCCCC(C)CCC CNP0003453.0 [1,1,0,0,0,0|1,0,1]=4 137 B14R0.393 CCCCCCCCCC[C@@H](O)CCC CNP0076547.2 [1,1,0,0,0,0|1,0,1]=4 138 B14R0.393 CCCCCCCCCC[C@H](O)CCC CNP0076547.1 [1,1,0,0,0,0|1,0,1]=4 139 B14R0.493 CCCCCCCCC[C@H](C)CCCC CNP0076142.1 [1,1,0,0,0,0|1,0,1]=4 140 B14R0.493 CCCC[C@H](O)CCCCCCCCO CNP0388153.1 [1,1,0,0,0,0|0,0,2]=4 141 B16R0.61 C=CCCCCCCCCCC[C@H](C)CCC CNP0080381.1 [0,2,0,0,0,0|1,0,0]=3 142 B16R0.61 CCCCCCCCCCCC[C@H](C)CCC CNP0157313.1 [0,2,0,0,0,0|1,0,1]=4 143 B16R0.61 CCOC(=O)CCCCCCCCCCC=O CNP0602430.0 [0,2,0,0,0,0|1,0,1]=4 144 B16R0.164 CC[C@H](C)CCCCCCCCC[C@H](O)CO CNP0371800.1 [0,2,0,0,0,0|0,0,2]=4 145 B16R0.165 CCC(=O)CCCCCCCCCCC(C)C CNP0333793.0 [0,2,0,0,0,0|0,0,0]=2 146 B16R0.165 CCC(C)CCCC=CCCCCCC(=O)C CNP0353161.0 [0,2,0,0,0,0|0,0,2]=4 147 B16R0.165 CCC(C)CCCCCCC=CCCC(=O)O CNP0219477.0 [0,2,0,0,0,0|0,0,2]=4 148 B16R0.165 CC[C@@H](C)CCCCCCCCCCC(=O)O CNP0162278.2 [0,2,0,0,0,0|0,0,0]=2 149 B16R0.165 CC[C@@H](C)CCCCCCCCCOC(=O)C CNP0202773.1 [0,2,0,0,0,0|1,0,0]=3 150 B16R0.165 CC[C@H](C)CCCCCCCCCCC(=O)O CNP0162278.1 [0,2,0,0,0,0|0,0,0]=2 151 B16R0.165 CC[C@H](C)CCCCCCCCCOC(=O)C CNP0202773.2 [0,2,0,0,0,0|1,0,0]=3 152 B16R0.165 COC(=O)CCCCCCCCCCC(=O)O CNP0162114.0 [0,2,0,0,0,0|1,0,1]=4 153 B16R0.165 COC(=O)CCCCCCCCCCC(C)C CNP0385887.0 [0,2,0,0,0,0|0,0,0]=2 154 B16R0.221 CCCCCCCCCCCCC[C@H](C)CC CNP0266860.1 [0,2,0,0,0,0|1,0,1]=4 155 B16R0.221 CCCCCCCCCCCCC[C@H](C)CO CNP0371129.1 [0,2,0,0,0,0|1,0,1]=4 156 B16R0.221 COC(=O)CCCCCCCCCCCC=O CNP0018335.0 [0,2,0,0,0,0|1,0,1]=4 157 B16R0.224 CCCCCCCCCCCCC(C)C(=O)C CNP0496216.0 [0,2,0,0,0,0|1,0,1]=4 158 B16R0.2265 CC(C)CCCCCCCCC[C@@H](O)C(=O)O CNP0278293.1 [0,2,0,0,0,0|0,0,0]=2 159 B16R0.3183 C=CCCCCCCCCC(=O)OCC(C)C CNP0399430.0 [0,2,0,0,0,0|1,0,1]=4 160 B16R0.274 CC(C)CCCCCCCCCC=CCC#N CNP0071936.0 [0,2,0,0,0,0|1,0,1]=4 161 B16R0.274 CC(C)CCCCCCCCCCCCCO CNP0105559.0 [0,2,0,0,0,0|0,0,2]=4 162 B16R0.274 CCCCCCCCC=CCCCCC(C)C CNP0609782.0 [0,2,0,0,0,0|1,0,1]=4 163 B16R0.274 CCCCCCCCCCCCCCC(C)C CNP0256136.0 [0,2,0,0,0,0|1,0,1]=4 164 B16R0.274 CCCCCCCCCCCCNCC(C)C CNP0078582.0 [0,2,0,0,0,0|1,0,1]=4 165 B16R0.1188 CC(C)(C)CCCCCCCCCCCCS CNP0454370.0 [0,2,0,0,0,0|0,1,1]=4 166 B16R0.1188 CCCCCCCCCCCCCC(C)(C)S CNP0262577.0 [0,2,0,0,0,0|1,0,1]=4 167 B16R0.3288 CC(=O)CCCCCC=CCCCCC(C)C CNP0342925.0 [0,2,0,0,0,0|0,0,1]=3 168 B16R0.3288 CC(=O)CCCCCCCC=CCCC(C)C CNP0353145.0 [0,2,0,0,0,0|0,0,1]=3 169 B16R0.3288 CC(C)CCC=CCCCCCCCC(=O)O CNP0018737.0 [0,2,0,0,0,0|0,0,1]=3 170 B16R0.3288 CC(C)CCCCC=CCCCCCC(=O)O CNP0017541.0 [0,2,0,0,0,0|0,0,1]=3 171 B16R0.3288 CC(C)CCCCCCCC=CCCC(=O)O CNP0018516.0 [0,2,0,0,0,0|0,0,1]=3 172 B16R0.3288 CC(C)CCCCCCCCCCCC(=O)N CNP0072512.0 [0,2,0,0,0,0|0,0,0]=2 173 B16R0.3288 CC(C)CCCCCCCCCCCC(=O)O CNP0240509.0 [0,2,0,0,0,0|0,0,0]=2 174 B16R0.3288 CC(O)CCCCCCCCCCCC(=O)O CNP0081935.0 [0,2,0,0,0,0|1,0,0]=3 175 B16R0.130 CCCC[C@@H](C)CCC[C@H](C)CCCC(C)C CNP0184993.1 [0,2,0,0,0,0|1,0,1]=4 176 B16R0.130 CCCC[C@H](C)CCC[C@H](C)CCCC(C)C CNP0184993.2 [0,2,0,0,0,0|1,0,1]=4 177 B16R0.2309 CC(=O)NCCCCCCCCCC(C)(C)O CNP0263638.0 [0,2,0,0,0,0|1,0,0]=3 178 B14R1.326 CC1CCCCCCCCCC(=O)O1 CNP0584711.0 [1,0,0,1,0,0|1,0,0]=3 179 B14R1.5883 CC1CCCCCCCCCC1(C)C CNP0611979.0 [1,0,0,1,0,0|0,0,1]=3 180 B14R1.123 CCCCCCCCC1CCCCC1 CNP0354404.0 [1,0,0,1,0,0|1,0,1]=4 181 B14R1.138 CCCCCCN1CCCCCC1=O CNP0044341.0 [1,0,0,1,0,0|1,0,0]=3 182 B14R1.216 CCCCCC=CCC1CCCC1=O CNP0180932.0 [1,0,0,1,0,0|0,0,2]=4 183 B14R1.247 C[C@@H]1CCCCCCCCCCC1=O CNP0376141.1 [1,0,0,1,0,0|0,0,0]=2 184 B14R1.247 C[C@H]1CCCCCCCCCCC1=O CNP0376141.2 [1,0,0,1,0,0|0,0,0]=2 185 B14R1.904 CCCC1CCCCC1CCCOC CNP0433257.0 [1,0,0,1,0,0|2,0,0]=4 186 B14R1.2874 C1CCCCCCCCCCCCC1 CNP0320476.0 [1,0,0,1,0,0|1,0,1]=4 187 B16R1.8780 CC1CCCCCCCCCCCC(=O)C1 CNP0086318.0 [0,1,0,1,0,0|0,0,0]=2 188 B16R1.8780 C[C@@H]1CCCCCC/C=C\CCCC(=O)O1 CNP0158821.1 [0,1,0,1,0,0|1,0,1]=4 189 B16R1.8780 C[C@H]1CCCCCC/C=C\CCCC(=O)O1 CNP0158821.2 [0,1,0,1,0,0|1,0,1]=4 190 B16R1.8780 C[C@H]1CCCCCCCCCCCC(=O)O1 CNP0261950.1 [0,1,0,1,0,0|1,0,0]=3 191 B16R1.8841 CC1CCCCCCCCCCC(=O)OC1 CNP0156010.0 [0,1,0,1,0,0|0,0,0]=2 192 B16R1.8841 C[C@@H]1CCCCCC/C=C\CCC(=O)OC1 CNP0147517.2 [0,1,0,1,0,0|0,0,2]=4 193 B16R1.8841 C[C@@H]1CCCCCCCCCCC(=O)OC1 CNP0156010.1 [0,1,0,1,0,0|0,0,0]=2 194 B16R1.8841 C[C@H]1CCCCCC/C=C\CCC(=O)OC1 CNP0147517.1 [0,1,0,1,0,0|0,0,2]=4 195 B16R2.3987 CC(C)N1CC[C@H]2CNCC[C@H]2CC1=O CNP0475217.1 [0,0,0,2,0,0|2,0,0]=4