0 B14R0.337 C#CCCCCCCCCCC(C)OC CNP0289200.0 [0,0,0,0,0,0|1,0,3]=4 1 B14R0.337 C=CC(=O)CCCCCCCCCCC CNP0334014.0 [0,0,0,0,0,0|1,0,1]=2 2 B14R0.337 C=CCCCCCCCCCC(=O)C=C CNP0297980.0 [0,0,0,0,0,0|1,0,3]=4 3 B14R0.337 CCC=CCCCCCCCC(=O)OC CNP0086356.0 [0,0,0,0,0,0|0,0,2]=2 4 B14R0.337 CCCCCC=CCC=CCC(=O)OC CNP0538053.0 [0,0,0,0,0,0|0,0,4]=4 5 B14R0.337 CCCCCC=CCCC=CC(=O)OC CNP0326443.0 [0,0,0,0,0,0|0,0,4]=4 6 B14R0.337 CCCCCCCC=CC=CC(=O)OC CNP0296655.0 [0,0,0,0,0,0|0,0,4]=4 7 B14R0.337 CCCCCCCCCC=CC(=O)OC CNP0281832.0 [0,0,0,0,0,0|0,0,2]=2 8 B14R0.337 CCCCCCCCCCCC(=O)CC CNP0260208.0 [0,0,0,0,0,0|1,0,0]=1 9 B14R0.337 CCCCCCCCCCCC(=O)CO CNP0162178.0 [0,0,0,0,0,0|2,0,0]=2 10 B14R0.337 CCCCCCCCCCCC(=O)OC CNP0307835.0 [0,0,0,0,0,0|0,0,0]=0 11 B14R0.337 CCCCCCCCCCC[C@H](C)CC CNP0294304.1 [0,0,0,0,0,0|2,0,1]=3 12 B14R0.337 CCCCCCCCCCOC(=O)CBr CNP0132290.0 [0,0,0,0,0,0|3,0,0]=3 13 B14R0.337 CCCCCCCCCCOC(=O)CC CNP0097861.0 [0,0,0,0,0,0|2,0,0]=2 14 B14R0.337 COC(=O)CCCCCCCC=CCO CNP0233627.0 [0,0,0,0,0,0|1,0,2]=3 15 B14R0.337 COC(=O)CCCCCCCCCC=O CNP0314293.0 [0,0,0,0,0,0|1,0,1]=2 16 B13R0.54 C=C(C)CCCCCCCCCCC CNP0076867.0 [1,0,0,0,0,0|1,0,0]=2 17 B13R0.54 C=CCCCCCCCCCC(=O)C CNP0306240.0 [1,0,0,0,0,0|0,0,2]=3 18 B13R0.54 C=CCCCCCCCCCC(=O)O CNP0172494.0 [1,0,0,0,0,0|0,0,2]=3 19 B13R0.54 C=CCCCCCCCCOC(=O)C CNP0555861.0 [1,0,0,0,0,0|1,0,2]=4 20 B13R0.54 CC(=O)OCCCCCCCCC=O CNP0547492.0 [1,0,0,0,0,0|2,0,1]=4 21 B13R0.54 CC(C)CCCCCCCCCCO CNP0498996.0 [1,0,0,0,0,0|2,0,1]=4 22 B13R0.54 CCC=CCCCCCCCC(=O)O CNP0316183.0 [1,0,0,0,0,0|0,0,2]=3 23 B13R0.54 CCCC=CCCCCCCC(=O)O CNP0213131.0 [1,0,0,0,0,0|0,0,2]=3 24 B13R0.54 CCCCC=CCCCCCC(=O)O CNP0155826.0 [1,0,0,0,0,0|0,0,2]=3 25 B13R0.54 CCCCC=CCCCCOC(=O)C CNP0154646.0 [1,0,0,0,0,0|1,0,2]=4 26 B13R0.54 CCCCCC=CCCCCC(=O)C CNP0213133.0 [1,0,0,0,0,0|0,0,2]=3 27 B13R0.54 CCCCCC=CCCCCC(=O)O CNP0611346.0 [1,0,0,0,0,0|0,0,2]=3 28 B13R0.54 CCCCCC=CCCCOC(=O)C CNP0003295.0 [1,0,0,0,0,0|1,0,2]=4 29 B13R0.54 CCCCCCC=CCCCC(=O)O CNP0163257.0 [1,0,0,0,0,0|0,0,2]=3 30 B13R0.54 CCCCCCCC=CCCC(=O)O CNP0181626.0 [1,0,0,0,0,0|0,0,2]=3 31 B13R0.54 CCCCCCCC=CCOC(=O)C CNP0123694.0 [1,0,0,0,0,0|1,0,2]=4 32 B13R0.54 CCCCCCCCC=CCC(=O)O CNP0579851.0 [1,0,0,0,0,0|0,0,2]=3 33 B13R0.54 CCCCCCCCC=COC(=O)C CNP0501330.0 [1,0,0,0,0,0|1,0,2]=4 34 B13R0.54 CCCCCCCCCC=CC(=O)C CNP0265083.0 [1,0,0,0,0,0|0,0,2]=3 35 B13R0.54 CCCCCCCCCC=CC(=O)O CNP0126369.0 [1,0,0,0,0,0|0,0,2]=3 36 B13R0.54 CCCCCCCCCCCC(=O)C CNP0221288.0 [1,0,0,0,0,0|0,0,0]=1 37 B13R0.54 CCCCCCCCCCCC(=O)N CNP0127821.0 [1,0,0,0,0,0|1,0,0]=2 38 B13R0.54 CCCCCCCCCCCC(=O)O CNP0303017.0 [1,0,0,0,0,0|0,0,0]=1 39 B13R0.54 CCCCCCCCCCCC(=O)[O-] CNP0514502.0 [1,0,0,0,0,0|0,0,1]=2 40 B13R0.54 CCCCCCCCCCCC(=O)[O-] CNP0526629.0 [1,0,0,0,0,0|0,0,1]=2 41 B13R0.54 CCCCCCCCCCCC(=O)[O-] CNP0526943.0 [1,0,0,0,0,0|0,0,1]=2 42 B13R0.54 CCCCCCCCCCCC(=O)[O-] CNP0575486.0 [1,0,0,0,0,0|0,0,1]=2 43 B13R0.54 CCCCCCCCCCCC(=O)[O-] CNP0604542.0 [1,0,0,0,0,0|0,0,1]=2 44 B13R0.54 CCCCCCCCCCCC(C)C CNP0149200.0 [1,0,0,0,0,0|1,0,1]=3 45 B13R0.54 CCCCCCCCCCC[C@@H](C)O CNP0149423.2 [1,0,0,0,0,0|0,0,2]=3 46 B13R0.54 CCCCCCCCCCC[C@H](C)O CNP0149423.1 [1,0,0,0,0,0|0,0,2]=3 47 B13R0.54 CCCCCCCCCCOC(=O)C CNP0190607.0 [1,0,0,0,0,0|1,0,0]=2 48 B13R0.54 CCCCCCCCCCOC(=O)S CNP0481026.0 [1,0,0,0,0,0|1,1,0]=3 49 B13R0.54 CCCCCCCCSCCC(=O)O CNP0574442.0 [1,0,0,0,0,0|1,0,0]=2 50 B13R0.54 CCCCOCCOCCOC(=O)C CNP0603936.0 [1,0,0,0,0,0|3,0,0]=4 51 B13R0.54 O=C(O)CCCCCCCC=CCO CNP0273167.0 [1,0,0,0,0,0|1,0,2]=4 52 B13R0.54 O=C(O)CCCCCCCCCCBr CNP0033746.0 [1,0,0,0,0,0|1,0,0]=2 53 B13R0.54 O=C(O)CCCCCCCCCCS CNP0586086.0 [1,0,0,0,0,0|1,0,0]=2 54 B13R0.54 O=CCCCCCCCCCC(=O)O CNP0102682.0 [1,0,0,0,0,0|1,0,1]=3 55 B13R0.54 [2H]C(=C)CCCCCCCCCCC CNP0557104.0 [1,0,0,0,0,0|1,0,1]=3 56 B13R0.147 C#CCCCCCCCCC(=O)OC CNP0522205.0 [1,0,0,0,0,0|0,0,2]=3 57 B13R0.147 C=CCCCCCCCCC(=O)OC CNP0148219.0 [1,0,0,0,0,0|0,0,2]=3 58 B13R0.147 CC=CCCCCCCCC(=O)OC CNP0092960.0 [1,0,0,0,0,0|0,0,2]=3 59 B13R0.147 CCCCCCCC=CCC(=O)CC CNP0527148.0 [1,0,0,0,0,0|1,0,2]=4 60 B13R0.147 CCCCCCCCC#CC(=O)OC CNP0140131.0 [1,0,0,0,0,0|0,0,2]=3 61 B13R0.147 CCCCCCCCC=CC(=O)OC CNP0122148.0 [1,0,0,0,0,0|0,0,2]=3 62 B13R0.147 CCCCCCCCCCC(=O)CC CNP0487301.0 [1,0,0,0,0,0|1,0,0]=2 63 B13R0.147 CCCCCCCCCCC(=O)OC CNP0117266.0 [1,0,0,0,0,0|0,0,0]=1 64 B13R0.147 CCCCCCCCCC[C@@H](C)CC CNP0232099.1 [1,0,0,0,0,0|2,0,1]=4 65 B13R0.147 CCCCCCCCCOC(=O)CC CNP0113142.0 [1,0,0,0,0,0|2,0,0]=3 66 B13R0.147 COC(=O)C=CCCCCCCCO CNP0218428.0 [1,0,0,0,0,0|1,0,2]=4 67 B13R0.147 COC(=O)CCCCCCC=CCO CNP0286839.0 [1,0,0,0,0,0|1,0,2]=4 68 B13R0.336 C#CCCCCCCCCCCCC CNP0579427.0 [1,0,0,0,0,0|1,0,2]=4 69 B13R0.336 C=CCCCCCCCCCCCC CNP0137398.0 [1,0,0,0,0,0|1,0,2]=4 70 B13R0.336 CC=CCCCCCCCCCCC CNP0269313.0 [1,0,0,0,0,0|1,0,0]=2 71 B13R0.336 CC=CCCCCCCCCCCO CNP0151348.0 [1,0,0,0,0,0|2,0,0]=3 72 B13R0.336 CCC=CCCCCCCCCCC CNP0003426.0 [1,0,0,0,0,0|1,0,1]=3 73 B13R0.336 CCC=CCCCCCCCCCO CNP0173162.0 [1,0,0,0,0,0|2,0,1]=4 74 B13R0.336 CCCCCCCCCCC=CC=O CNP0146353.0 [1,0,0,0,0,0|2,0,1]=4 75 B13R0.336 CCCCCCCCCCC=CCO CNP0096544.0 [1,0,0,0,0,0|2,0,1]=4 76 B13R0.336 CCCCCCCCCCCC=CO CNP0586715.0 [1,0,0,0,0,0|2,0,0]=3 77 B13R0.336 CCCCCCCCCCCC=NO CNP0018714.0 [1,0,0,0,0,0|2,0,0]=3 78 B13R0.336 CCCCCCCCCCCCC#N CNP0226803.0 [1,0,0,0,0,0|2,0,1]=4 79 B13R0.336 CCCCCCCCCCCCC=O CNP0222214.0 [1,0,0,0,0,0|2,0,1]=4 80 B13R0.336 CCCCCCCCCCCCCC CNP0293304.0 [1,0,0,0,0,0|1,0,1]=3 81 B13R0.336 CCCCCCCCCCCCCI CNP0486092.0 [1,0,0,0,0,0|2,0,1]=4 82 B13R0.336 CCCCCCCCCCCCCN CNP0561220.0 [1,0,0,0,0,0|2,0,1]=4 83 B13R0.336 CCCCCCCCCCCCCO CNP0139347.0 [1,0,0,0,0,0|2,0,1]=4 84 B13R0.336 CCCCCCCCCCCOC=O CNP0085671.0 [1,0,0,0,0,0|3,0,0]=4 85 B15R0.81 CCCCCCCCCCC=CC(=O)OC CNP0291148.0 [0,1,0,0,0,0|0,0,1]=2 86 B15R0.81 CCCCCCCCCCCCC(=O)OC CNP0210866.0 [0,1,0,0,0,0|0,0,0]=1 87 B15R0.81 CCCCCCCCCCCC[C@@H](C)CC CNP0322318.2 [0,1,0,0,0,0|2,0,1]=4 88 B15R0.81 CCCCCCCCCCCC[C@H](C)CC CNP0322318.1 [0,1,0,0,0,0|2,0,1]=4 89 B15R0.81 CCCCCCCCCCCOC(=O)CC CNP0236979.0 [0,1,0,0,0,0|1,0,0]=2 90 B15R0.81 CC[C@H](C)CCCCCCCCCCCN CNP0288451.1 [0,1,0,0,0,0|2,0,1]=4 91 B15R0.81 CC[C@H](C)CCCCCCCCCCCO CNP0193546.1 [0,1,0,0,0,0|2,0,1]=4 92 B15R0.81 COC(=O)CCCCCCCC=CCCO CNP0332831.0 [0,1,0,0,0,0|0,0,2]=3 93 B15R0.81 COC(=O)CCCCCCCCC=CC=O CNP0327747.0 [0,1,0,0,0,0|0,0,3]=4 94 B15R0.81 COC(=O)CCCCCCCCCCCO CNP0267260.0 [0,1,0,0,0,0|0,0,0]=1 95 B15R0.84 C=C(C)C(=O)OCCCCCCCCCC CNP0077255.0 [0,1,0,0,0,0|2,0,0]=3 96 B15R0.84 CCCCCCCCCCC[C@@H](C)C(=O)C CNP0377330.1 [0,1,0,0,0,0|2,0,1]=4 97 B15R0.84 CCCCCCCCCCC[C@@H](O)[C@H](C)N CNP0291425.1 [0,1,0,0,0,0|1,0,2]=4 98 B15R0.84 CCCCCCCCCCC[C@H](O)[C@@H](C)N CNP0291425.3 [0,1,0,0,0,0|1,0,2]=4 99 B15R0.84 CCCCCCCCCCC[C@H](O)[C@H](C)N CNP0291425.2 [0,1,0,0,0,0|1,0,2]=4 100 B15R0.84 CCCCCCCCCCOC(=O)C(C)C CNP0611686.0 [0,1,0,0,0,0|2,0,0]=3 101 B15R0.84 CCCCCCCCCCOC(=O)C(Cl)Cl CNP0086443.0 [0,1,0,0,0,0|3,0,0]=4 102 B15R0.137 C/C=C(\C)/CCC[C@@H](O)CCCCCCC CNP0328255.1 [0,1,0,0,0,0|2,0,0]=3 103 B15R0.137 CCCCCCCC(=O)CCCC(=O)OC CNP0207879.0 [0,1,0,0,0,0|0,0,1]=2 104 B15R0.172 CCC(=O)CCCCCCCCC(C)CC CNP0284050.0 [0,1,0,0,0,0|1,0,0]=2 105 B15R0.172 CC[C@@H](C)CCCCCCCCC(=O)OC CNP0309732.1 [0,1,0,0,0,0|0,0,0]=1 106 B15R0.172 CC[C@H](C)CCCCCCCCC(=O)OC CNP0309732.2 [0,1,0,0,0,0|0,0,0]=1 107 B15R0.172 COC(=O)CCCCCCCCC(=O)OC CNP0302547.0 [0,1,0,0,0,0|1,0,1]=3 108 B15R0.209 CCCC[C@@H](O)CCCCCCC(=O)OC CNP0281979.1 [0,1,0,0,0,0|0,0,0]=1 109 B15R0.233 CCCCCC(=O)CCCCCC(=O)OC CNP0320441.0 [0,1,0,0,0,0|0,0,1]=2 110 B15R0.247 COC(=O)CCCCCCCCCC(C)C CNP0027527.0 [0,1,0,0,0,0|0,0,0]=1 111 B15R0.247 COC(=O)CCCCCCCCC[C@@H](C)O CNP0259120.1 [0,1,0,0,0,0|0,0,0]=1 112 B15R0.253 CCCCCCCCCCCC(OC)OC CNP0003282.0 [0,1,0,0,0,0|0,0,2]=3 113 B15R0.254 CCCCCCCCCCC[P@](=O)(O)OC CNP0506108.1 [0,1,0,0,0,0|1,0,0]=2 114 B15R0.324 CCCCCCCCCC[C@@H](C)C(=O)OC CNP0245672.1 [0,1,0,0,0,0|0,0,0]=1 115 B15R0.366 C=COC(=O)CCCCCCCCCCC CNP0315574.0 [0,1,0,0,0,0|0,0,1]=2 116 B15R0.366 CCCCCCCCCC=CC(=O)OCC CNP0203006.0 [0,1,0,0,0,0|0,0,2]=3 117 B15R0.366 CCCCCCCCCCCC(=O)CC=O CNP0349328.0 [0,1,0,0,0,0|1,0,1]=3 118 B15R0.366 CCCCCCCCCCCC(=O)CCO CNP0280181.0 [0,1,0,0,0,0|1,0,0]=2 119 B15R0.366 CCCCCCCCCCCC(=O)NCC CNP0001305.0 [0,1,0,0,0,0|1,0,0]=2 120 B15R0.366 CCCCCCCCCCCC(=O)OCC CNP0263071.0 [0,1,0,0,0,0|0,0,0]=1 121 B15R0.366 CCCCCCCCCCCC(C)CCC CNP0084820.0 [0,1,0,0,0,0|2,0,1]=4 122 B15R0.366 CCCCCCCCCCOC(=O)CCC CNP0186393.0 [0,1,0,0,0,0|2,0,0]=3 123 B15R0.366 CCOC(=O)CCCCCCCCCC=O CNP0279106.0 [0,1,0,0,0,0|1,0,1]=3 124 B15R0.2405 CCCCCCCCC(=O)CCC(=O)OC CNP0158431.0 [0,1,0,0,0,0|0,0,1]=2 125 B15R0.3221 CCCCCCCCCC(=CC(=O)OC)C CNP0230553.0 [0,1,0,0,0,0|0,0,2]=3 126 B15R0.3221 CCCCCCCCC[C@H](C)CC(=O)OC CNP0308441.1 [0,1,0,0,0,0|0,0,0]=1 127 B15R1.253 N[C@H]1CCCCCCCCCCNC1=O CNP0547506.1 [0,0,0,1,0,0|3,0,0]=4 128 B15R1.6595 O=C1C=CCCCCCCCCCCC1 CNP0071987.0 [0,0,0,1,0,0|1,0,1]=3 129 B15R1.6595 O=C1CCCC=CCCCCCCCC1 CNP0321790.0 [0,0,0,1,0,0|1,0,2]=4 130 B15R1.6595 O=C1CCCCCCCCCCCCC1 CNP0211498.0 [0,0,0,1,0,0|1,0,0]=2 131 B15R1.6595 O=C1CCCCCCCCCCCCO1 CNP0407259.0 [0,0,0,1,0,0|0,0,0]=1 132 B15R1.11631 COC(=O)CCCCCCCCC1CC1 CNP0418126.0 [0,0,0,1,0,0|0,0,0]=1 133 B15R1.11631 COC(=O)CCCCCCCC[C@@H]1CO1 CNP0286552.2 [0,0,0,1,0,0|1,0,0]=2 134 B15R1.11631 COC(=O)CCCCCCCC[C@H]1CO1 CNP0286552.1 [0,0,0,1,0,0|1,0,0]=2 135 B12R0.5 C=CCCCCCCCCCCC CNP0324663.0 [2,0,0,0,0,0|0,0,1]=3 136 B12R0.5 C=CCCCCCCCCCCO CNP0237635.0 [2,0,0,0,0,0|1,0,1]=4 137 B12R0.5 CC=CCCCCCCCCCC CNP0504957.0 [2,0,0,0,0,0|0,0,1]=3 138 B12R0.5 CC=CCCCCCCCCCO CNP0177650.0 [2,0,0,0,0,0|1,0,1]=4 139 B12R0.5 CCC=CCCCCCCCC=O CNP0222286.0 [2,0,0,0,0,0|0,0,2]=4 140 B12R0.5 CCC=CCCCCCCCCC CNP0534908.0 [2,0,0,0,0,0|1,0,1]=4 141 B12R0.5 CCCCC=CCCCCCC=O CNP0318145.0 [2,0,0,0,0,0|0,0,2]=4 142 B12R0.5 CCCCCC=CCCCCC=O CNP0590554.0 [2,0,0,0,0,0|0,0,2]=4 143 B12R0.5 CCCCCCC=CCCCC=O CNP0205630.0 [2,0,0,0,0,0|0,0,2]=4 144 B12R0.5 CCCCCCCCCC=CC=O CNP0141647.0 [2,0,0,0,0,0|0,0,2]=4 145 B12R0.5 CCCCCCCCCCC=CO CNP0086116.0 [2,0,0,0,0,0|0,0,1]=3 146 B12R0.5 CCCCCCCCCCCC#N CNP0071944.0 [2,0,0,0,0,0|1,0,1]=4 147 B12R0.5 CCCCCCCCCCCC=O CNP0211650.0 [2,0,0,0,0,0|0,0,0]=2 148 B12R0.5 CCCCCCCCCCCCC CNP0251262.0 [2,0,0,0,0,0|0,0,1]=3 149 B12R0.5 CCCCCCCCCCCCO CNP0281602.0 [2,0,0,0,0,0|0,0,1]=3 150 B12R0.5 CCCCCCCCCCOC=O CNP0485887.0 [2,0,0,0,0,0|1,0,0]=3 151 B12R0.5 CCCCCCCCCCOCO CNP0587051.0 [2,0,0,0,0,0|1,0,1]=4 152 B12R0.5 CCCCCCCCCOCCC CNP0508454.0 [2,0,0,0,0,0|1,0,1]=4 153 B12R0.5 CCCCCCNCCCCCC CNP0462839.0 [2,0,0,0,0,0|1,0,1]=4 154 B12R0.5 CCCCCCOCCCCCC CNP0492138.0 [2,0,0,0,0,0|1,0,1]=4 155 B12R0.5 OCCCCCCCCCCCO CNP0368503.0 [2,0,0,0,0,0|1,0,1]=4 156 B12R0.234 C#CCCCCCCCCC(=O)O CNP0190624.0 [2,0,0,0,0,0|0,0,2]=4 157 B12R0.234 C=CCCCCCCCCC(=O)O CNP0198208.0 [2,0,0,0,0,0|0,0,2]=4 158 B12R0.234 CC#CCCCCCCCC(=O)O CNP0171980.0 [2,0,0,0,0,0|0,0,2]=4 159 B12R0.234 CCCCCCCC=CCC(=O)C CNP0496301.0 [2,0,0,0,0,0|0,0,2]=4 160 B12R0.234 CCCCCCCCC=CC(=O)O CNP0422564.0 [2,0,0,0,0,0|0,0,2]=4 161 B12R0.234 CCCCCCCCCCC(=O)C CNP0168691.0 [2,0,0,0,0,0|0,0,0]=2 162 B12R0.234 CCCCCCCCCCC(=O)O CNP0154912.0 [2,0,0,0,0,0|0,0,0]=2 163 B12R0.234 CCCCCCCCCCC(C)C CNP0258052.0 [2,0,0,0,0,0|1,0,1]=4 164 B12R0.234 CCCCCCCCCCC(O)O CNP0076204.0 [2,0,0,0,0,0|0,0,2]=4 165 B12R0.234 CCCCCCCCCC[C@H](C)O CNP0327823.1 [2,0,0,0,0,0|0,0,2]=4 166 B12R0.234 CCCCCCCCCOC(=O)C CNP0250890.0 [2,0,0,0,0,0|1,0,0]=3 167 B12R0.234 O=C(O)CCCCCCCCCO CNP0294307.0 [2,0,0,0,0,0|1,0,0]=3 168 B12R0.248 C#CCCCCCCCC(=O)OC CNP0179424.0 [2,0,0,0,0,0|0,0,2]=4 169 B12R0.248 C=CC(=O)CCCCCCCCC CNP0105121.0 [2,0,0,0,0,0|1,0,1]=4 170 B12R0.248 C=CCCCCCCCC(=O)OC CNP0363612.0 [2,0,0,0,0,0|0,0,2]=4 171 B12R0.248 CCCCCC=CCCC(=O)OC CNP0112743.0 [2,0,0,0,0,0|0,0,2]=4 172 B12R0.248 CCCCCCCC=CC(=O)OC CNP0075998.0 [2,0,0,0,0,0|0,0,2]=4 173 B12R0.248 CCCCCCCCCC(=O)CC CNP0517584.0 [2,0,0,0,0,0|1,0,0]=3 174 B12R0.248 CCCCCCCCCC(=O)OC CNP0223324.0 [2,0,0,0,0,0|0,0,0]=2 175 B12R0.248 CCCCCCCCOC(=O)CC CNP0215951.0 [2,0,0,0,0,0|2,0,0]=4 176 B12R0.248 COC(=O)CCCCCCCC=O CNP0287915.0 [2,0,0,0,0,0|1,0,1]=4 177 B12R0.248 COC(=O)CCCCCCCCO CNP0294192.0 [2,0,0,0,0,0|1,0,0]=3 178 B14R0.2 CCCCCCCC(=O)CCCC(=O)O CNP0193723.0 [1,1,0,0,0,0|0,0,1]=3 179 B14R0.2 CCCCCCCC(=O)CCSC(=O)C CNP0294221.0 [1,1,0,0,0,0|1,0,1]=4 180 B14R0.2 CCCCCCCC(C)CCCC(=O)C CNP0524173.0 [1,1,0,0,0,0|0,0,0]=2 181 B14R0.2 CCCCCCCC(O)CCCC(=O)O CNP0411141.0 [1,1,0,0,0,0|0,0,0]=2 182 B14R0.68 CC(=O)CCCCCCCCCC(=O)O CNP0305653.0 [1,1,0,0,0,0|0,0,1]=3 183 B14R0.68 CC(=O)CCCCCCCCNC(=O)C CNP0346976.0 [1,1,0,0,0,0|1,0,1]=4 184 B14R0.68 CC(C)CCCCCCCC=CC(=O)O CNP0304027.0 [1,1,0,0,0,0|0,0,2]=4 185 B14R0.68 CC(C)CCCCCCCCCC(=O)O CNP0314744.0 [1,1,0,0,0,0|0,0,0]=2 186 B14R0.68 CC(C)CCCCCCCCCC(C)O CNP0610273.0 [1,1,0,0,0,0|0,0,2]=4 187 B14R0.68 C[C@H](O)CCCCCCCCCC(=O)O CNP0271260.1 [1,1,0,0,0,0|0,0,0]=2 188 B14R0.68 O=C(O)CCCCCCCCCC(=O)O CNP0292095.0 [1,1,0,0,0,0|1,0,1]=4 189 B14R0.88 CCCCCCCCCCC[N+](C)(C)[O-] CNP0557509.0 [1,1,0,0,0,0|1,0,1]=4 190 B14R0.88 CCCCCCCCCCNS(=O)(=O)O CNP0476658.0 [1,1,0,0,0,0|2,0,0]=4 191 B14R0.88 CCCCCCCCCCOS(=O)(=O)O CNP0421232.0 [1,1,0,0,0,0|2,0,0]=4 192 B14R0.153 CCCC[C@H](O)CCCCCCC(=O)O CNP0106337.1 [1,1,0,0,0,0|0,0,0]=2 193 B14R0.231 CCCCC[C@H](O)CCCCCC(=O)O CNP0102854.1 [1,1,0,0,0,0|0,0,0]=2 194 B14R0.305 CCC(C)CCCCCCCCC(=O)C CNP0210226.0 [1,1,0,0,0,0|0,0,0]=2 195 B14R0.305 CC[C@@H](C)CCCCCCCCC(=O)O CNP0277749.2 [1,1,0,0,0,0|0,0,0]=2 196 B14R0.305 CC[C@H](C)CCCCCCCCC(=O)O CNP0277749.1 [1,1,0,0,0,0|0,0,0]=2 197 B14R0.305 CC[C@H](O)CCCCCCCCC(=O)O CNP0298538.1 [1,1,0,0,0,0|0,0,0]=2 198 B14R0.305 COC(=O)CCCCCCCCC(=O)C CNP0275083.0 [1,1,0,0,0,0|1,0,1]=4 199 B14R0.305 COC(=O)CCCCCCCCC(=O)O CNP0362278.0 [1,1,0,0,0,0|1,0,1]=4 200 B14R0.340 CCCCCCCCCCC(C)C(=O)C CNP0499802.0 [1,1,0,0,0,0|0,0,0]=2 201 B14R0.340 CCCCCCCCCC[C@@H](C)C(=O)O CNP0172373.1 [1,1,0,0,0,0|0,0,0]=2 202 B14R0.340 CCCCCCCCCC[C@@H](O)C(=O)O CNP0195070.1 [1,1,0,0,0,0|0,0,0]=2 203 B14R0.340 CCCCCCCCCC[C@H](O)C(=O)O CNP0195070.2 [1,1,0,0,0,0|0,0,0]=2 204 B14R0.340 CSCCCCCCCCC(=O)C(=O)O CNP0295831.0 [1,1,0,0,0,0|1,0,1]=4 205 B14R0.340 CSCCCCCCCC[C@H](N)C(=O)O CNP0359900.1 [1,1,0,0,0,0|1,0,0]=3 206 B14R0.340 NCCCCNCCCC[C@H](N)C(=O)O CNP0157534.1 [1,1,0,0,0,0|2,0,0]=4 207 B14R0.344 CCCCCCCCC(=O)NCC(=O)O CNP0001598.0 [1,1,0,0,0,0|1,0,1]=4 208 B14R0.344 CCCCCCCCC(C)CCC(=O)O CNP0598565.0 [1,1,0,0,0,0|0,0,0]=2 209 B14R0.344 CCCCCCCCC(C)CCC(C)C CNP0072523.0 [1,1,0,0,0,0|1,0,1]=4 210 B14R0.344 CCCCCCCC[C@@H](O)C#CC(=O)O CNP0458691.1 [1,1,0,0,0,0|0,0,2]=4 211 B14R0.344 CCCCCCCC[C@@H](O)CCC(=O)O CNP0550827.1 [1,1,0,0,0,0|0,0,0]=2 212 B14R0.344 CCCCCCCC[C@H](O)C#CC(=O)O CNP0458691.2 [1,1,0,0,0,0|0,0,2]=4 213 B14R0.344 CCCCCCCC[C@H](O)CCC(=O)O CNP0550827.2 [1,1,0,0,0,0|0,0,0]=2 214 B14R0.391 CCCCC/C=C\CC[C@@H](O)CC(=O)O CNP0299790.1 [1,1,0,0,0,0|0,0,2]=4 215 B14R0.391 CCCCCC/C=C\C[C@@H](O)CC(=O)O CNP0293461.1 [1,1,0,0,0,0|0,0,2]=4 216 B14R0.391 CCCCCC/C=C\C[C@H](O)CC(=O)O CNP0293461.2 [1,1,0,0,0,0|0,0,2]=4 217 B14R0.391 CCCCCCC=CCC(C)CC(=O)O CNP0071919.0 [1,1,0,0,0,0|0,0,2]=4 218 B14R0.391 CCCCCCCCCC(=O)CC(=O)O CNP0069141.0 [1,1,0,0,0,0|0,0,1]=3 219 B14R0.391 CCCCCCCCC[C@@H](C)OC(=O)C CNP0165028.2 [1,1,0,0,0,0|1,0,0]=3 220 B14R0.391 CCCCCCCCC[C@@H](O)CC(=O)O CNP0220266.1 [1,1,0,0,0,0|0,0,0]=2 221 B14R0.391 CCCCCCCCC[C@H](C)OC(=O)C CNP0165028.1 [1,1,0,0,0,0|1,0,0]=3 222 B14R0.391 CCCCCCCCC[C@H](O)CC(=O)O CNP0220266.2 [1,1,0,0,0,0|0,0,0]=2 223 B14R0.394 C#CCCCCCCCCCCC(=O)C CNP0503056.0 [1,1,0,0,0,0|0,0,1]=3 224 B14R0.394 C=CCCCCCCCCCOC(=O)C CNP0003547.0 [1,1,0,0,0,0|0,0,2]=4 225 B14R0.394 CC(C)CCCCCCCCCCCN CNP0301011.0 [1,1,0,0,0,0|1,0,1]=4 226 B14R0.394 CC=CCCCCCCCCOC(=O)C CNP0308487.0 [1,1,0,0,0,0|0,0,2]=4 227 B14R0.394 CCCC=CCCCCCCOC(=O)C CNP0162411.0 [1,1,0,0,0,0|0,0,2]=4 228 B14R0.394 CCCCCC=CCCCCCC(=O)O CNP0547535.0 [1,1,0,0,0,0|0,0,1]=3 229 B14R0.394 CCCCCCC=CCCCCC(=O)C CNP0245771.0 [1,1,0,0,0,0|0,0,1]=3 230 B14R0.394 CCCCCCCCCCC=CC(=O)O CNP0334789.0 [1,1,0,0,0,0|0,0,1]=3 231 B14R0.394 CCCCCCCCCCCCC(=O)C CNP0420877.0 [1,1,0,0,0,0|0,0,0]=2 232 B14R0.394 CCCCCCCCCCCCC(=O)N CNP0216559.0 [1,1,0,0,0,0|1,0,0]=3 233 B14R0.394 CCCCCCCCCCCCC(=O)O CNP0145185.0 [1,1,0,0,0,0|0,0,0]=2 234 B14R0.394 CCCCCCCCCCCCC(C)C CNP0391491.0 [1,1,0,0,0,0|1,0,1]=4 235 B14R0.394 CCCCCCCCCCCCC(C)O CNP0214390.0 [1,1,0,0,0,0|0,0,2]=4 236 B14R0.394 CCCCCCCCCCCCN(C)C CNP0476829.0 [1,1,0,0,0,0|2,0,0]=4 237 B14R0.394 CCCCCCCCCCCOC(=O)C CNP0260334.0 [1,1,0,0,0,0|0,0,0]=2 238 B14R0.394 NCCCCCCCCCCCC(=O)O CNP0125044.0 [1,1,0,0,0,0|0,0,0]=2 239 B14R0.394 O=C(O)CCCCCCCC=CCCO CNP0178804.0 [1,1,0,0,0,0|0,0,2]=4 240 B14R0.394 O=C(O)CCCCCCCCCCCBr CNP0057228.0 [1,1,0,0,0,0|0,0,0]=2 241 B14R0.394 O=C(O)CCCCCCCCCCCO CNP0273728.0 [1,1,0,0,0,0|0,0,0]=2 242 B14R0.394 [2H]CCCCCCCCCCCC(=O)O CNP0602095.0 [1,1,0,0,0,0|0,0,0]=2 243 B14R0.432 CCCC(C)CCCCCCCC(=O)O CNP0278697.0 [1,1,0,0,0,0|0,0,0]=2 244 B14R0.432 CCC[C@@H](C)CCCCCCCC(=O)C CNP0218330.1 [1,1,0,0,0,0|0,0,0]=2 245 B14R0.432 CCC[C@H](O)CCCCCCCC(=O)O CNP0325800.1 [1,1,0,0,0,0|0,0,0]=2 246 B14R0.432 CCOC(=O)CCCCCCCC(=O)O CNP0155089.0 [1,1,0,0,0,0|1,0,1]=4 247 B14R0.2224 CCCCCC[C@H](O)CCCCC(=O)O CNP0295458.1 [1,1,0,0,0,0|0,0,0]=2 248 B14R0.82 CCCCCCCCC(C)OC(=O)CC CNP0495734.0 [1,1,0,0,0,0|2,0,0]=4 249 B14R0.82 CCCCCCCC[C@H](C)CC(=O)OC CNP0107547.1 [1,1,0,0,0,0|0,0,0]=2 250 B14R0.197 CC[C@@H](C)CCCCCCCC(=O)OC CNP0042483.1 [1,1,0,0,0,0|0,0,0]=2 251 B14R0.197 CC[C@H](C)CCCCCCCC(=O)OC CNP0042483.2 [1,1,0,0,0,0|0,0,0]=2 252 B14R0.197 COC(=O)CCCCCCCC(=O)OC CNP0189349.0 [1,1,0,0,0,0|1,0,1]=4 253 B14R0.226 CCCCCC(=O)CCCCC(=O)OC CNP0136352.0 [1,1,0,0,0,0|0,0,1]=3 254 B14R0.393 C=CCCCCCCCCC(=O)OCC CNP0247664.0 [1,1,0,0,0,0|0,0,2]=4 255 B14R0.393 CCCCCCCCCCC(=O)OCC CNP0025805.0 [1,1,0,0,0,0|0,0,0]=2 256 B14R0.393 CCOC(=O)CCCCCCCCCBr CNP0024178.0 [1,1,0,0,0,0|1,0,0]=3 257 B14R0.145 CCCCCCCC(O)CCCCCC CNP0151041.0 [1,1,0,0,0,0|1,0,1]=4 258 B14R0.145 CCCCCCC[C@@H](C)CCCCCC CNP0316250.1 [1,1,0,0,0,0|1,0,1]=4 259 B14R0.145 CCCCCCC[C@H](C)CCCCCC CNP0316250.2 [1,1,0,0,0,0|1,0,1]=4 260 B14R0.392 C=CC=CCCCCCCCCCCC CNP0497045.0 [1,1,0,0,0,0|1,0,1]=4 261 B14R0.392 CC=CC#CCCCCCCCCCC CNP0224690.0 [1,1,0,0,0,0|1,0,1]=4 262 B14R0.392 CC=CCCCCCCCCCCCC CNP0134200.0 [1,1,0,0,0,0|1,0,0]=3 263 B14R0.392 CC=CCCCCCCCCCCCO CNP0292605.0 [1,1,0,0,0,0|1,0,0]=3 264 B14R0.392 CCC=CCCCCCCCCCCO CNP0175758.0 [1,1,0,0,0,0|1,0,1]=4 265 B14R0.392 CCCCCCCCCCC=CCCO CNP0306792.0 [1,1,0,0,0,0|1,0,1]=4 266 B14R0.392 CCCCCCCCCCCC=CC=O CNP0054792.0 [1,1,0,0,0,0|1,0,1]=4 267 B14R0.392 CCCCCCCCCCCC=CCO CNP0358958.0 [1,1,0,0,0,0|1,0,0]=3 268 B14R0.392 CCCCCCCCCCCCCCC CNP0314547.0 [1,1,0,0,0,0|1,0,1]=4 269 B14R0.392 CCCCCCCCCCCCCCCl CNP0509321.0 [1,1,0,0,0,0|1,0,1]=4 270 B14R0.392 CCCCCCCCCCCCCCI CNP0576364.0 [1,1,0,0,0,0|1,0,1]=4 271 B14R0.392 CCCCCCCCCCCCCCN CNP0079841.0 [1,1,0,0,0,0|1,0,1]=4 272 B14R0.392 CCCCCCCCCCCCCCO CNP0209818.0 [1,1,0,0,0,0|1,0,1]=4 273 B14R0.392 CCCCCCCCCCCCCC[11CH3] CNP0480041.0 [1,1,0,0,0,0|1,0,1]=4 274 B14R0.392 CCCCCCCCOCCCCCC CNP0511916.0 [1,1,0,0,0,0|1,0,1]=4 275 B14R0.392 COOCCCCCCCCCOOC CNP0080398.0 [1,1,0,0,0,0|2,0,0]=4 276 B14R0.493 CCCCCCCCC[C@H](C)CCCC CNP0076142.1 [1,1,0,0,0,0|1,0,1]=4 277 B16R0.61 CCCCCCCCCCCCC(=O)CCC CNP0585123.0 [0,2,0,0,0,0|1,0,0]=3 278 B16R0.61 CCCCCCCCCCCCC(=O)OCC CNP0154229.0 [0,2,0,0,0,0|0,0,0]=2 279 B16R0.61 CCOC(=O)CCCCCCCCCCC=O CNP0602430.0 [0,2,0,0,0,0|0,0,1]=3 280 B16R0.70 C=CC(C)C(=O)CCCCCCCCCCC CNP0085709.0 [0,2,0,0,0,0|1,0,0]=3 281 B16R0.70 CCCCCCCCCCC[C@@H](C)C(=O)OC CNP0222948.1 [0,2,0,0,0,0|0,0,0]=2 282 B16R0.70 CCCCCCCCCCOC(=O)[C@H](C)CC CNP0154359.1 [0,2,0,0,0,0|2,0,0]=4 283 B16R0.164 CC[C@@H](C)CCCCCCCCCC(=O)OC CNP0150975.2 [0,2,0,0,0,0|0,0,0]=2 284 B16R0.164 CC[C@H](C)CCCCCCCCCC(=O)OC CNP0150975.1 [0,2,0,0,0,0|0,0,0]=2 285 B16R0.164 COC(=O)CCCCCCCCCC(=O)OC CNP0276425.0 [0,2,0,0,0,0|0,0,1]=3 286 B16R0.165 CCC(=O)CCCCCCCCCCC(C)C CNP0333793.0 [0,2,0,0,0,0|1,0,0]=3 287 B16R0.165 COC(=O)CCCCCCCCCCC(=O)O CNP0162114.0 [0,2,0,0,0,0|0,0,1]=3 288 B16R0.165 COC(=O)CCCCCCCCCCC(C)C CNP0385887.0 [0,2,0,0,0,0|0,0,0]=2 289 B16R0.221 C=CC(=O)OCCCCCCCCCCCC CNP0018126.0 [0,2,0,0,0,0|1,0,1]=4 290 B16R0.221 C=CCCCCCCCCCCCC(=O)C=C CNP0155328.0 [0,2,0,0,0,0|1,0,1]=4 291 B16R0.221 CCC=C=CCCCCCCCCC(=O)OC CNP0533247.0 [0,2,0,0,0,0|0,0,1]=3 292 B16R0.221 CCC=CCCCCCCCCOC(=O)CC CNP0126558.0 [0,2,0,0,0,0|1,0,1]=4 293 B16R0.221 CCCCC=CCCCCCCCC(=O)OC CNP0150160.0 [0,2,0,0,0,0|0,0,0]=2 294 B16R0.221 CCCCCC=CCC=CCCCC(=O)OC CNP0344541.0 [0,2,0,0,0,0|0,0,2]=4 295 B16R0.221 CCCCCCCCCC=CC=CC(=O)OC CNP0300034.0 [0,2,0,0,0,0|0,0,2]=4 296 B16R0.221 CCCCCCCCCC=CCCC(=O)OC CNP0195665.0 [0,2,0,0,0,0|0,0,0]=2 297 B16R0.221 CCCCCCCCCCCC=CC(=O)OC CNP0295487.0 [0,2,0,0,0,0|0,0,0]=2 298 B16R0.221 CCCCCCCCCCCCCC(=O)CC CNP0113176.0 [0,2,0,0,0,0|1,0,0]=3 299 B16R0.221 CCCCCCCCCCCCCC(=O)NN CNP0308205.0 [0,2,0,0,0,0|2,0,0]=4 300 B16R0.221 CCCCCCCCCCCCCC(=O)OC CNP0250171.0 [0,2,0,0,0,0|0,0,0]=2 301 B16R0.221 CCCCCCCCCCCCOC(=O)CC CNP0245605.0 [0,2,0,0,0,0|1,0,0]=3 302 B16R0.221 COC(=O)CCCCC=CCCCCCCO CNP0196105.0 [0,2,0,0,0,0|0,0,1]=3 303 B16R0.221 COC(=O)CCCCCCCCCCCC=O CNP0018335.0 [0,2,0,0,0,0|0,0,0]=2 304 B16R0.224 CCCCCCCCCCCCC(=O)C(=O)O CNP0589314.0 [0,2,0,0,0,0|2,0,0]=4 305 B16R0.806 COC(=O)CCCCCCCC[C@@H](O)CNO CNP0387042.1 [0,2,0,0,0,0|1,0,0]=3 306 B16R0.806 COC(=O)CCCCCCCC[C@H](O)CNO CNP0387042.2 [0,2,0,0,0,0|1,0,0]=3 307 B16R0.1182 CCCCCCCCCC[C@H](C)CC(=O)OC CNP0221878.1 [0,2,0,0,0,0|0,0,0]=2 308 B16R0.1182 CCCCCCCCCC[C@H](C)OC(=O)CC CNP0115872.1 [0,2,0,0,0,0|1,0,0]=3 309 B16R0.25 COC(=O)C=CCC(O)CCCCCC(C)O CNP0436213.0 [0,2,0,0,0,0|0,0,2]=4 310 B16R0.113 CCCCCCC[C@H](O)C[C@H](O)CC(=O)OC CNP0551290.1 [0,2,0,0,0,0|0,0,0]=2 311 B16R0.127 CCCCCCC[C@H](C)CC[C@@H](C)C(=O)OC CNP0106740.1 [0,2,0,0,0,0|0,0,0]=2 312 B16R0.2840 CCC[C@H](O)C/C=C/[C@@H](O)CCCC(=O)OC CNP0102423.1 [0,2,0,0,0,0|0,0,2]=4 313 B16R0.1284 CC[C@H](C)CCCCCCC[C@@H](C)C(=O)OC CNP0141224.1 [0,2,0,0,0,0|0,0,0]=2 314 B16R0.7311 CCC(C)CCCCCC(C)CCC(=O)OC CNP0351974.0 [0,2,0,0,0,0|0,0,0]=2 315 B16R0.1096 CCCCCC[C@H](C)CCC[C@@H](C)C(=O)OC CNP0139438.1 [0,2,0,0,0,0|0,0,0]=2 316 B16R0.3394 COC(=O)C=CC(O)CCCCCCC(C)O CNP0466941.0 [0,2,0,0,0,0|0,0,2]=4 317 B16R0.3394 COC(=O)CCC(C)CCCCCCC(C)C CNP0220724.0 [0,2,0,0,0,0|0,0,0]=2 318 B16R0.7985 COC(=O)CC(O)CCCCCCCC(=O)C CNP0281589.0 [0,2,0,0,0,0|0,0,1]=3 319 B16R0.7985 COC(=O)C[C@H](O)CCCCCCCC(=O)C CNP0281589.1 [0,2,0,0,0,0|0,0,1]=3 320 B16R0.7985 COC(=O)C[C@H](O)CCCCCCCC(C)C CNP0104429.1 [0,2,0,0,0,0|0,0,0]=2 321 B16R0.7985 COC(=O)C[C@H](O)CCCCCCC[C@@H](C)O CNP0129782.1 [0,2,0,0,0,0|0,0,0]=2 322 B16R0.1183 CCCCCCCCCCC(Cl)C(=O)OCCl CNP0075169.0 [0,2,0,0,0,0|0,0,0]=2 323 B16R0.97 CCOC(=O)CCCCCCCC(=O)OCC CNP0174241.0 [0,2,0,0,0,0|1,0,1]=4 324 B16R0.137 CCCCCCCCC(=O)CCC(=O)OCC CNP0273581.0 [0,2,0,0,0,0|0,0,1]=3 325 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)O CNP0069770.0 [0,2,0,0,0,0|1,0,1]=4 326 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C CNP0001279.0 [0,2,0,0,0,0|1,0,0]=3 327 B16R0.302 CCCCCCCCCCCC(=O)OC(C)C CNP0353162.0 [0,2,0,0,0,0|0,0,0]=2 328 B16R0.302 CCCCCCCCCCC[C@H](C)OC(=O)C CNP0269231.1 [0,2,0,0,0,0|1,0,1]=4 329 B16R0.302 CCCCCCCCCCOS(=O)OC(C)C CNP0512614.0 [0,2,0,0,0,0|2,0,0]=4 330 B16R0.661 CCCCCCCCCCCC(=O)NCCC CNP0212712.0 [0,2,0,0,0,0|1,0,0]=3 331 B16R0.661 CCCCCCCCCCCC(=O)NCCO CNP0433424.0 [0,2,0,0,0,0|1,0,0]=3 332 B16R0.661 CCCCCCCCCCCC(=O)OCCC CNP0609098.0 [0,2,0,0,0,0|0,0,0]=2 333 B14R1.26 CCCCCCC[C@@H]1CC=CC(=O)O1 CNP0175844.1 [1,0,0,1,0,0|0,0,2]=4 334 B14R1.26 CCCCCCC[C@H]1CCCC(=O)O1 CNP0316484.1 [1,0,0,1,0,0|0,0,0]=2 335 B14R1.122 CCCCC/C=C/C[C@@H]1CCC(=O)O1 CNP0208703.2 [1,0,0,1,0,0|0,0,2]=4 336 B14R1.122 CCCCC/C=C/C[C@H]1CCC(=O)O1 CNP0208703.1 [1,0,0,1,0,0|0,0,2]=4 337 B14R1.122 CCCCC/C=C\C[C@@H]1CCC(=O)O1 CNP0208703.3 [1,0,0,1,0,0|0,0,2]=4 338 B14R1.122 CCCCC/C=C\C[C@H]1CCC(=O)O1 CNP0208703.4 [1,0,0,1,0,0|0,0,2]=4 339 B14R1.122 CCCCCC/C=C/[C@@H]1CCC(=O)O1 CNP0179736.1 [1,0,0,1,0,0|0,0,2]=4 340 B14R1.122 CCCCCC/C=C/[C@H]1CCC(=O)O1 CNP0179736.3 [1,0,0,1,0,0|0,0,2]=4 341 B14R1.122 CCCCCC/C=C\[C@H]1CCC(=O)O1 CNP0179736.2 [1,0,0,1,0,0|0,0,2]=4 342 B14R1.122 CCCCCCCC[C@@H]1CCC(=O)O1 CNP0390908.2 [1,0,0,1,0,0|0,0,0]=2 343 B14R1.122 CCCCCCCC[C@H]1CCC(=O)O1 CNP0390908.1 [1,0,0,1,0,0|0,0,0]=2 344 B14R1.241 C[C@H]1O[C@H]1CCCCCCCC(=O)O CNP0262619.1 [1,0,0,1,0,0|1,0,0]=3 345 B14R1.326 CC1CCCCC=CCCCC(=O)O1 CNP0304698.0 [1,0,0,1,0,0|0,0,2]=4 346 B14R1.326 CC1CCCCCCCCCC(=O)O1 CNP0584711.0 [1,0,0,1,0,0|0,0,0]=2 347 B14R1.326 C[C@@H]1C/C=C/CCCCCCC(=O)O1 CNP0142568.1 [1,0,0,1,0,0|0,0,2]=4 348 B14R1.326 C[C@@H]1C/C=C\CCCCCCC(=O)O1 CNP0142568.3 [1,0,0,1,0,0|0,0,2]=4 349 B14R1.326 C[C@@H]1CCCCCC/C=C\CC(=O)O1 CNP0330088.2 [1,0,0,1,0,0|0,0,2]=4 350 B14R1.326 C[C@H]1C/C=C/CCCCCCC(=O)O1 CNP0142568.2 [1,0,0,1,0,0|0,0,2]=4 351 B14R1.326 C[C@H]1CCCC/C=C\CCCC(=O)O1 CNP0304698.1 [1,0,0,1,0,0|0,0,2]=4 352 B14R1.326 C[C@H]1CCCCCC/C=C\CC(=O)O1 CNP0330088.1 [1,0,0,1,0,0|0,0,2]=4 353 B14R1.427 O=C(O)CCCCCC[C@@H]1C=CCC1 CNP0191653.1 [1,0,0,1,0,0|0,0,2]=4 354 B14R1.427 O=C(O)CCCCCC[C@H]1C=CCC1 CNP0191653.2 [1,0,0,1,0,0|0,0,2]=4 355 B14R1.1252 CCCCCCC1CCCCC(=O)O1 CNP0301204.0 [1,0,0,1,0,0|0,0,0]=2 356 B14R1.1252 CCCCCC[C@H]1CC(=O)CCSS1 CNP0264209.1 [1,0,0,1,0,0|2,0,0]=4 357 B14R1.4408 O=C1CC=CCCCCCCCCO1 CNP0106632.0 [1,0,0,1,0,0|0,0,2]=4 358 B14R1.4408 O=C1CCCCCCCC=CCCO1 CNP0208635.0 [1,0,0,1,0,0|0,0,2]=4 359 B14R1.4408 O=C1CCCCCCCCC=CCO1 CNP0609723.0 [1,0,0,1,0,0|0,0,2]=4 360 B14R1.4408 O=C1CCCCCCCCCCCO1 CNP0320182.0 [1,0,0,1,0,0|0,0,0]=2 361 B14R1.4728 CCCCCCCC[C@@H]1C[C@@H]1C(=O)N CNP0285116.2 [1,0,0,1,0,0|1,0,0]=3 362 B14R1.4728 CCCCCCCC[C@@H]1C[C@H]1C(=O)N CNP0285116.3 [1,0,0,1,0,0|1,0,0]=3 363 B14R1.4728 CCCCCCCC[C@H]1C[C@@H]1C(=O)N CNP0285116.1 [1,0,0,1,0,0|1,0,0]=3 364 B14R1.4728 CCCCCCCC[C@H]1C[C@H]1C(=O)N CNP0285116.4 [1,0,0,1,0,0|1,0,0]=3 365 B14R1.4728 CCCCCCCC[C@H]1O[C@@H]1C(=O)C CNP0337041.1 [1,0,0,1,0,0|1,0,0]=3 366 B14R1.5883 CC1CCCCCCCCCC1(C)C CNP0611979.0 [1,0,0,1,0,0|1,0,1]=4 367 B14R1.6388 O=C(O)CCCCCCCCC1CC1 CNP0507777.0 [1,0,0,1,0,0|0,0,0]=2 368 B14R1.247 C[C@@H]1CCCCCCCCCCC1=O CNP0376141.1 [1,0,0,1,0,0|1,0,0]=3 369 B14R1.247 C[C@H]1CCCCCCCCCCC1=O CNP0376141.2 [1,0,0,1,0,0|1,0,0]=3 370 B14R1.1247 CCCCCC[C@H]1C[C@@H]1CC(=O)OC CNP0242920.1 [1,0,0,1,0,0|0,0,0]=2 371 B14R1.123 CCCCCCCCC1CCCCC1 CNP0354404.0 [1,0,0,1,0,0|1,0,1]=4 372 B14R1.904 CCCC1CCCCC1CCCOC CNP0433257.0 [1,0,0,1,0,0|0,0,1]=3 373 B14R1.2874 C1CCCCCCCCCCCCC1 CNP0320476.0 [1,0,0,1,0,0|1,0,1]=4 374 B16R1.402 C[C@H]1CCCCCCCCCCCOC1=O CNP0258710.1 [0,1,0,1,0,0|0,0,0]=2 375 B16R1.402 O=C1CCCCCCCCCCCCC1=O CNP0584718.0 [0,1,0,1,0,0|1,0,0]=3 376 B16R1.642 CCCCCCCCCC[C@@H]1CCC(=O)O1 CNP0302354.1 [0,1,0,1,0,0|1,0,0]=3 377 B16R1.8816 O=C1CCCC=CCCCCCCCCC1 CNP0316245.0 [0,1,0,1,0,0|1,0,1]=4 378 B16R1.8816 O=C1CCCC=CCCCCCCCCO1 CNP0260386.0 [0,1,0,1,0,0|0,0,1]=3 379 B16R1.8816 O=C1CCCCCCCCCCCCCC1 CNP0222423.0 [0,1,0,1,0,0|1,0,0]=3 380 B16R1.8816 O=C1CCCCCCCCCCCCCO1 CNP0160622.0 [0,1,0,1,0,0|0,0,0]=2 381 B16R1.8816 O=C1CCCCCCCCCCOCCO1 CNP0127605.0 [0,1,0,1,0,0|0,0,0]=2 382 B16R1.8841 CC1CCCCCCCCCCC(=O)OC1 CNP0156010.0 [0,1,0,1,0,0|0,0,0]=2 383 B16R1.8841 C[C@@H]1CCCCCC/C=C\CCC(=O)OC1 CNP0147517.2 [0,1,0,1,0,0|0,0,1]=3 384 B16R1.8841 C[C@@H]1CCCCCCCCCCC(=O)OC1 CNP0156010.1 [0,1,0,1,0,0|0,0,0]=2 385 B16R1.8841 C[C@H]1CCCCCC/C=C\CCC(=O)OC1 CNP0147517.1 [0,1,0,1,0,0|0,0,1]=3 386 B16R1.17553 CCCCCCCCC[C@@H]1O[C@H]1C(=O)OC CNP0106207.1 [0,1,0,1,0,0|0,0,0]=2 387 B16R1.26934 CC/C=C\C[C@@H]1[C@H](CC[C@H]1O)CC(=O)OC CNP0241005.3 [0,1,0,1,0,0|0,0,2]=4 388 B16R1.26934 CC/C=C\C[C@H]1[C@@H](CC[C@@H]1O)CC(=O)OC CNP0241005.1 [0,1,0,1,0,0|0,0,2]=4 389 B16R1.26934 CC/C=C\C[C@H]1[C@H](CC[C@@H]1O)CC(=O)OC CNP0241005.2 [0,1,0,1,0,0|0,0,2]=4 390 B16R1.26934 CCCCC[C@@H]1C(=O)CC[C@@H]1CC(=O)OC CNP0239046.2 [0,1,0,1,0,0|0,0,1]=3 391 B16R1.26934 CCCCC[C@@H]1C(=O)CC[C@H]1CC(=O)OC CNP0239046.4 [0,1,0,1,0,0|0,0,1]=3 392 B16R1.26934 CCCCC[C@@H]1[C@@H](CC[C@@H]1O)CC(=O)OC CNP0362362.1 [0,1,0,1,0,0|0,0,0]=2 393 B16R1.26934 CCCCC[C@@H]1[C@H](CC[C@@H]1O)CC(=O)OC CNP0362362.4 [0,1,0,1,0,0|0,0,0]=2 394 B16R1.26934 CCCCC[C@H]1C(=O)CC[C@@H]1CC(=O)OC CNP0239046.1 [0,1,0,1,0,0|0,0,1]=3 395 B16R1.26934 CCCCC[C@H]1C(=O)CC[C@H]1CC(=O)OC CNP0239046.3 [0,1,0,1,0,0|0,0,1]=3 396 B16R1.26934 CCCCC[C@H]1[C@@H](CC[C@@H]1O)CC(=O)OC CNP0362362.3 [0,1,0,1,0,0|0,0,0]=2 397 B16R1.26934 CCCCC[C@H]1[C@H](CC[C@@H]1O)CC(=O)OC CNP0362362.2 [0,1,0,1,0,0|0,0,0]=2 398 B16R1.1411 CCCCC[C@@H]1CCC[C@@H](N1)CC(=O)OC CNP0277387.1 [0,1,0,1,0,0|0,0,0]=2 399 B16R1.1411 CCCCC[C@H]1CCC[C@@H](N1)CC(=O)OC CNP0277387.2 [0,1,0,1,0,0|0,0,0]=2 400 B16R1.6680 CCCCCCCCCCN1CCCC1=O CNP0534295.0 [0,1,0,1,0,0|2,0,0]=4 401 B16R1.27 CCCCCCCCCC1CCCC(=O)O1 CNP0142097.0 [0,1,0,1,0,0|2,0,0]=4 402 B16R1.27 CCCCCCCCC[C@@H]1CC=CC(=O)O1 CNP0272113.1 [0,1,0,1,0,0|2,0,0]=4 403 B16R1.4695 CCCCCCCCCC1CC(=O)OC1=O CNP0203615.0 [0,1,0,1,0,0|0,0,1]=3 404 B16R1.8780 CC1CCCCCCCCCCCC(=O)C1 CNP0086318.0 [0,1,0,1,0,0|1,0,0]=3 405 B16R1.8780 C[C@@H]1CCCCCC/C=C\CCCC(=O)O1 CNP0158821.1 [0,1,0,1,0,0|0,0,2]=4 406 B16R1.8780 C[C@H]1CCCCCC/C=C\CCCC(=O)O1 CNP0158821.2 [0,1,0,1,0,0|0,0,2]=4 407 B16R1.8780 C[C@H]1CCCCCCCCCCCC(=O)O1 CNP0261950.1 [0,1,0,1,0,0|0,0,0]=2