0 B13R0.2 C=CCCCCCCCC(=O)OCC CNP0561434.0 [0,0,0,0,0,0|2,0,2]=4 1 B13R0.2 C=COC(=O)CCCCCCCCC CNP0137792.0 [0,0,0,0,0,0|2,0,2]=4 2 B13R0.2 CCCCCC=CCCC(=O)OCC CNP0247879.0 [0,0,0,0,0,0|2,0,2]=4 3 B13R0.2 CCCCCC=CCOC(=O)CCC CNP0047858.0 [0,0,0,0,0,0|0,0,2]=2 4 B13R0.2 CCCCCCC=COC(=O)CCC CNP0492034.0 [0,0,0,0,0,0|0,0,2]=2 5 B13R0.2 CCCCCCCC=CC(=O)OCC CNP0323878.0 [0,0,0,0,0,0|2,0,1]=3 6 B13R0.2 CCCCCCCCCC(=O)CC=O CNP0246850.0 [0,0,0,0,0,0|2,0,1]=3 7 B13R0.2 CCCCCCCCCC(=O)CCC CNP0343183.0 [0,0,0,0,0,0|1,0,0]=1 8 B13R0.2 CCCCCCCCCC(=O)OCC CNP0245893.0 [0,0,0,0,0,0|2,0,0]=2 9 B13R0.2 CCCCCCCCCC(C)CCC CNP0097879.0 [0,0,0,0,0,0|2,0,1]=3 10 B13R0.2 CCCCCCCCOC(=O)CCC CNP0140143.0 [0,0,0,0,0,0|0,0,0]=0 11 B13R0.2 CCCCCCOCCC(C)CCC CNP0085746.0 [0,0,0,0,0,0|3,0,1]=4 12 B13R0.2 CCOC(=O)CCCCCCCC=O CNP0276438.0 [0,0,0,0,0,0|3,0,1]=4 13 B13R0.2 CCOC(=O)CCCCCCCCO CNP0242583.0 [0,0,0,0,0,0|3,0,0]=3 14 B12R0.1 CC=CC(=O)CCCCCCCC CNP0482568.0 [1,0,0,0,0,0|0,0,2]=3 15 B12R0.1 CCCCCC=CCC(=O)OCC CNP0584413.0 [1,0,0,0,0,0|1,0,2]=4 16 B12R0.1 CCCCCCC#CC(=O)OCC CNP0031634.0 [1,0,0,0,0,0|1,0,2]=4 17 B12R0.1 CCCCCCC=CC(=O)OCC CNP0307887.0 [1,0,0,0,0,0|1,0,2]=4 18 B12R0.1 CCCCCCCCC(=O)OCC CNP0255123.0 [1,0,0,0,0,0|1,0,0]=2 19 B12R0.1 CCCCCCCC[C@H](C)CCC CNP0076722.1 [1,0,0,0,0,0|1,0,1]=3 20 B12R0.1 CCCCCCCC[S@@+]([O-])CCO CNP0546559.1 [1,0,0,0,0,0|2,0,1]=4 21 B12R0.1 CCCCCCCOC(=O)CCC CNP0077240.0 [1,0,0,0,0,0|0,0,0]=1 22 B12R0.5 CCC=CCCCCCCCCC CNP0534908.0 [1,0,0,0,0,0|1,0,1]=3 23 B12R0.5 CCC=CCCCCCCCCO CNP0133783.0 [1,0,0,0,0,0|2,0,1]=4 24 B12R0.5 CCCC=CC#CCCCCCC CNP0146170.0 [1,0,0,0,0,0|1,0,2]=4 25 B12R0.5 CCCC=CCCCCCCCO CNP0274278.0 [1,0,0,0,0,0|2,0,0]=3 26 B12R0.5 CCCCC=CCCCCCCC CNP0586294.0 [1,0,0,0,0,0|1,0,2]=4 27 B12R0.5 CCCCCCCCC=CCCO CNP0107866.0 [1,0,0,0,0,0|2,0,0]=3 28 B12R0.5 CCCCCCCCCC=CCO CNP0254277.0 [1,0,0,0,0,0|2,0,1]=4 29 B12R0.5 CCCCCCCCCCCCC CNP0251262.0 [1,0,0,0,0,0|1,0,1]=3 30 B12R0.5 CCCCCCCCCCCCO CNP0281602.0 [1,0,0,0,0,0|2,0,1]=4 31 B12R0.5 CCCCCCCCCOCCC CNP0508454.0 [1,0,0,0,0,0|2,0,0]=3 32 B12R0.5 CCCCCCNCCCCCC CNP0462839.0 [1,0,0,0,0,0|2,0,1]=4 33 B12R0.5 CCCCCCOCCCCCC CNP0492138.0 [1,0,0,0,0,0|2,0,1]=4 34 B12R0.248 C=CC(=O)CCCCCCCCC CNP0105121.0 [1,0,0,0,0,0|1,0,2]=4 35 B12R0.248 C=CC(=O)OCCCCCCCC CNP0564168.0 [1,0,0,0,0,0|0,0,2]=3 36 B12R0.248 CCC=CCCCCOC(=O)CC CNP0209959.0 [1,0,0,0,0,0|0,0,2]=3 37 B12R0.248 CCCCC=CCCOC(=O)CC CNP0105555.0 [1,0,0,0,0,0|0,0,2]=3 38 B12R0.248 CCCCCCCC=CC(=O)OC CNP0075998.0 [1,0,0,0,0,0|2,0,1]=4 39 B12R0.248 CCCCCCCCCC(=O)CC CNP0517584.0 [1,0,0,0,0,0|1,0,0]=2 40 B12R0.248 CCCCCCCCCC(=O)OC CNP0223324.0 [1,0,0,0,0,0|2,0,0]=3 41 B12R0.248 CCCCCCCCCC(C)CC CNP0349662.0 [1,0,0,0,0,0|2,0,1]=4 42 B12R0.248 CCCCCCCCOC(=O)CC CNP0215951.0 [1,0,0,0,0,0|0,0,0]=1 43 B12R0.248 COC(=O)CCCCCCCCO CNP0294192.0 [1,0,0,0,0,0|3,0,0]=4 44 B14R0.73 CCCCCCCC(=O)O[C@H](C)CCC CNP0184238.1 [0,1,0,0,0,0|1,0,2]=4 45 B14R0.181 CCCCCCCCCC(=O)C(C)CC CNP0351856.0 [0,1,0,0,0,0|1,0,0]=2 46 B14R0.181 CCCCCCCCCC(=O)C(O)CC CNP0152109.0 [0,1,0,0,0,0|1,0,0]=2 47 B14R0.181 CCCCCCCCOC(=O)[C@H](C)CC CNP0410814.1 [0,1,0,0,0,0|0,0,0]=1 48 B14R0.391 CC(C)OC(=O)CCCCCCCCO CNP0392498.0 [0,1,0,0,0,0|3,0,0]=4 49 B14R0.391 CCCCCCCCCC(=O)C=C(C)C CNP0232845.0 [0,1,0,0,0,0|1,0,2]=4 50 B14R0.391 CCCCCCCCCC(=O)CC(=O)O CNP0069141.0 [0,1,0,0,0,0|2,0,1]=4 51 B14R0.391 CCCCCCCCCC(=O)OC(C)C CNP0080469.0 [0,1,0,0,0,0|2,0,0]=3 52 B14R0.391 CCCCCCCCOC(=O)C=C(I)I CNP0262240.0 [0,1,0,0,0,0|1,0,2]=4 53 B14R0.391 CCCCCCCCOC(=O)CC(C)C CNP0321210.0 [0,1,0,0,0,0|0,0,0]=1 54 B14R0.391 CSCCCCCCNC(=O)NC(C)C CNP0394012.0 [0,1,0,0,0,0|3,0,0]=4 55 B14R0.393 C=CCCCCCCCCC(=O)OCC CNP0247664.0 [0,1,0,0,0,0|2,0,1]=4 56 B14R0.393 CCCCCCCCCCC(=O)OCC CNP0025805.0 [0,1,0,0,0,0|2,0,0]=3 57 B14R0.393 CCCCCCCCCCC(C)CCC CNP0003453.0 [0,1,0,0,0,0|2,0,1]=4 58 B14R0.393 CCCCCCCCCC[C@@H](O)CCC CNP0076547.2 [0,1,0,0,0,0|1,0,2]=4 59 B14R0.393 CCCCCCCCCC[C@H](O)CCC CNP0076547.1 [0,1,0,0,0,0|1,0,2]=4 60 B14R0.393 CCOC(=O)CCCCCCCCCBr CNP0024178.0 [0,1,0,0,0,0|2,0,0]=3 61 B14R0.493 CCCCCCCCCC(=O)CCCC CNP0481269.0 [0,1,0,0,0,0|1,0,0]=2 62 B14R0.493 CCCCCCCCCC(=O)OCCC CNP0095402.0 [0,1,0,0,0,0|1,0,0]=2 63 B14R0.493 CCCCCCCCC[C@H](C)CCCC CNP0076142.1 [0,1,0,0,0,0|2,0,1]=4 64 B14R0.493 CCCCCCCCOC(=O)CCCC CNP0076933.0 [0,1,0,0,0,0|0,0,0]=1 65 B14R0.493 CCCOC(=O)CCCCCCCCO CNP0133360.0 [0,1,0,0,0,0|2,0,0]=3 66 B14R0.2432 CCCCC[C@@H](C)CCC[C@@H](C)CCC CNP0250251.2 [0,1,0,0,0,0|2,0,1]=4 67 B14R0.2432 CCCCC[C@H](C)CCC[C@H](C)CCC CNP0250251.1 [0,1,0,0,0,0|2,0,1]=4 68 B14R0.2432 CCCCC[C@H](O)CCC[C@H](O)CCC CNP0416178.1 [0,1,0,0,0,0|1,0,2]=4 69 B14R1.26 CCCCCCC[C@@H]1CC=CC(=O)O1 CNP0175844.1 [0,0,0,1,0,0|0,0,2]=3 70 B14R1.26 CCCCCCC[C@H]1CCCC(=O)O1 CNP0316484.1 [0,0,0,1,0,0|0,0,0]=1 71 B14R1.216 CCCCCC=CCC1CCCC1=O CNP0180932.0 [0,0,0,1,0,0|1,0,2]=4 72 B14R1.326 CC1CCCCCCCCCC(=O)O1 CNP0584711.0 [0,0,0,1,0,0|2,0,0]=3 73 B14R1.965 CCOC(=O)C[C@@H]1CCNC[C@@H]1CC CNP0264127.1 [0,0,0,1,0,0|3,0,0]=4 74 B14R1.3126 CCCCCCC[C@H]1OC(=O)C[C@H]1C CNP0537001.1 [0,0,0,1,0,0|0,0,0]=1 75 B14R1.4408 O=C1CC=CCCCCCCCCO1 CNP0106632.0 [0,0,0,1,0,0|0,0,2]=3 76 B14R1.4408 O=C1CCCCCCCC=CCCO1 CNP0208635.0 [0,0,0,1,0,0|0,0,2]=3 77 B14R1.4408 O=C1CCCCCCCCC=CCO1 CNP0609723.0 [0,0,0,1,0,0|0,0,2]=3 78 B14R1.4408 O=C1CCCCCCCCCCCO1 CNP0320182.0 [0,0,0,1,0,0|0,0,0]=1 79 B11R0.3 CC=CCCCCCCCCC CNP0084835.0 [2,0,0,0,0,0|1,0,1]=4 80 B11R0.3 CCC=CCCCCCCCC CNP0223387.0 [2,0,0,0,0,0|0,0,1]=3 81 B11R0.3 CCCC=CCCCCCCO CNP0282171.0 [2,0,0,0,0,0|1,0,1]=4 82 B11R0.3 CCCCCCCCC=CCO CNP0086126.0 [2,0,0,0,0,0|1,0,1]=4 83 B11R0.3 CCCCCCCCCCCC CNP0299960.0 [2,0,0,0,0,0|0,0,1]=3 84 B11R0.3 CCCCCCCCCCCO CNP0115710.0 [2,0,0,0,0,0|1,0,1]=4 85 B11R0.3 CCCCCCCCCCNC CNP0142745.0 [2,0,0,0,0,0|1,0,1]=4 86 B11R0.3 CCCCCCCCOCCO CNP0598116.0 [2,0,0,0,0,0|1,0,0]=3 87 B11R0.3 CCCCOCCOCCCC CNP0542178.0 [2,0,0,0,0,0|1,0,1]=4 88 B11R0.3 [CH2]CCCCCCCCCCC CNP0562200.0 [2,0,0,0,0,0|0,0,2]=4 89 B11R0.4 CC=CC(=O)OCCCCCC CNP0002922.0 [2,0,0,0,0,0|0,0,2]=4 90 B11R0.4 CC=CCCCOC(=O)CCC CNP0508923.0 [2,0,0,0,0,0|0,0,2]=4 91 B11R0.4 CCC=CCCOC(=O)CCC CNP0286866.0 [2,0,0,0,0,0|0,0,2]=4 92 B11R0.4 CCCC=CCOC(=O)CCC CNP0260808.0 [2,0,0,0,0,0|0,0,2]=4 93 B11R0.4 CCCCCCCC(=O)CCC CNP0224296.0 [2,0,0,0,0,0|0,0,0]=2 94 B11R0.4 CCCCCCCC(=O)OCC CNP0311189.0 [2,0,0,0,0,0|1,0,0]=3 95 B11R0.4 CCCCCCCC(C)CCC CNP0333661.0 [2,0,0,0,0,0|1,0,1]=4 96 B11R0.4 CCCCCCC[C@@H](O)CCC CNP0081402.1 [2,0,0,0,0,0|0,0,2]=4 97 B11R0.4 CCCCCCOC(=O)CCC CNP0153531.0 [2,0,0,0,0,0|0,0,0]=2 98 B11R0.40 C=C(CC)CCCCCCCC CNP0359541.0 [2,0,0,0,0,0|1,0,0]=3 99 B11R0.40 C=CC(=O)CCCCCCCC CNP0104265.0 [2,0,0,0,0,0|0,0,2]=4 100 B11R0.40 CCCCCCCCC(=O)CC CNP0144959.0 [2,0,0,0,0,0|0,0,0]=2 101 B11R0.40 CCCCCCCCC(=O)OC CNP0418286.0 [2,0,0,0,0,0|1,0,0]=3 102 B11R0.40 CCCCCCCCC(O)CC CNP0589699.0 [2,0,0,0,0,0|0,0,2]=4 103 B11R0.40 CCCCCCCC[C@H](C)CC CNP0096496.1 [2,0,0,0,0,0|1,0,1]=4 104 B11R0.40 CCCCCCCOC(=O)CC CNP0602844.0 [2,0,0,0,0,0|0,0,0]=2 105 B11R0.40 COC(=O)CCCCCCCO CNP0247810.0 [2,0,0,0,0,0|2,0,0]=4 106 B11R0.148 CCC=CCCCCOC(=O)C CNP0017686.0 [2,0,0,0,0,0|0,0,2]=4 107 B11R0.148 CCCCC=CCCOC(=O)C CNP0536667.0 [2,0,0,0,0,0|0,0,2]=4 108 B11R0.148 CCCCCC=CCOC(=O)C CNP0255180.0 [2,0,0,0,0,0|0,0,2]=4 109 B11R0.148 CCCCCCC=COC(=O)C CNP0097984.0 [2,0,0,0,0,0|0,0,2]=4 110 B11R0.148 CCCCCCCC=CC(=O)C CNP0126399.0 [2,0,0,0,0,0|1,0,1]=4 111 B11R0.148 CCCCCCCCC=C(C)C CNP0555992.0 [2,0,0,0,0,0|2,0,0]=4 112 B11R0.148 CCCCCCCCCC(=O)C CNP0310446.0 [2,0,0,0,0,0|1,0,0]=3 113 B11R0.148 CCCCCCCCCC(=O)Cl CNP0310799.0 [2,0,0,0,0,0|2,0,0]=4 114 B11R0.148 CCCCCCCCCC(=O)N CNP0196101.0 [2,0,0,0,0,0|2,0,0]=4 115 B11R0.148 CCCCCCCCCC(=O)O CNP0213238.0 [2,0,0,0,0,0|2,0,0]=4 116 B11R0.148 CCCCCCCCCC(=O)S CNP0175900.0 [2,0,0,0,0,0|2,0,0]=4 117 B11R0.148 CCCCCCCCCC(=O)[O-] CNP0527675.0 [2,0,0,0,0,0|2,0,0]=4 118 B11R0.148 CCCCCCCCCC(=O)[O-] CNP0527709.0 [2,0,0,0,0,0|2,0,0]=4 119 B11R0.148 CCCCCCCCCC(=O)[O-] CNP0572352.0 [2,0,0,0,0,0|2,0,0]=4 120 B11R0.148 CCCCCCCCCC(=O)[O-] CNP0599431.0 [2,0,0,0,0,0|2,0,0]=4 121 B11R0.148 CCCCCCCCCC(=O)[O-] CNP0602582.0 [2,0,0,0,0,0|2,0,0]=4 122 B11R0.148 CCCCCCCCOC(=O)C CNP0207320.0 [2,0,0,0,0,0|0,0,0]=2 123 B11R0.148 CCCCCCCCO[13C](=O)C CNP0542593.0 [2,0,0,0,0,0|0,0,0]=2 124 B11R0.148 CCCCCCCCSC(=O)C CNP0537924.0 [2,0,0,0,0,0|0,1,0]=3 125 B11R0.148 CCCCCOCCOC(=O)C CNP0497389.0 [2,0,0,0,0,0|1,0,0]=3 126 B13R0.66 C=CCOC(=O)CCCCCCCC CNP0131773.0 [1,1,0,0,0,0|0,0,2]=4 127 B13R0.66 CCCCCCCOC(=O)CCCC CNP0231760.0 [1,1,0,0,0,0|0,0,0]=2 128 B13R0.88 CCCC(=O)CCCCCCC(C)C CNP0307359.0 [1,1,0,0,0,0|0,0,0]=2 129 B13R0.88 CCOC(=O)CCCCCC[C@@H](C)O CNP0112958.1 [1,1,0,0,0,0|1,0,0]=3 130 B13R0.193 CCCCCC(=O)CCC(=O)OCC CNP0017938.0 [1,1,0,0,0,0|1,0,1]=4 131 B13R0.330 CCCCCC[C@@H](C)C[C@@H](C)CCC CNP0248871.1 [1,1,0,0,0,0|1,0,1]=4 132 B13R0.330 CCCCCC[C@H](C)C[C@H](C)CCC CNP0248871.2 [1,1,0,0,0,0|1,0,1]=4 133 B13R0.330 CCCCCC[C@H](O)CC(=O)OCC CNP0291447.1 [1,1,0,0,0,0|1,0,0]=3 134 B13R0.335 CCCCCCCCC(=O)OC(C)C CNP0003082.0 [1,1,0,0,0,0|1,0,0]=3 135 B13R0.335 CCCCCCCC[C@H](C)CC(C)C CNP0331374.1 [1,1,0,0,0,0|1,0,1]=4 136 B13R0.335 CCCCCCCOC(=O)CC(C)C CNP0076121.0 [1,1,0,0,0,0|0,0,0]=2 137 B13R0.340 CCCCCCCOC(=O)[C@H](C)CC CNP0135717.1 [1,1,0,0,0,0|0,0,0]=2 138 B13R0.54 CC/C=C/CCCCCCC[C@H](C)O CNP0191015.1 [1,1,0,0,0,0|1,0,1]=4 139 B13R0.54 CCCCCCCCCCCC(C)C CNP0149200.0 [1,1,0,0,0,0|1,0,1]=4 140 B13R0.54 CCCCCCCCCCC[C@@H](C)O CNP0149423.2 [1,1,0,0,0,0|1,0,1]=4 141 B13R0.54 CCCCCCCCCCC[C@H](C)O CNP0149423.1 [1,1,0,0,0,0|1,0,1]=4 142 B13R0.147 CCCCCCCCCC[C@@H](C)CC CNP0232099.1 [1,1,0,0,0,0|1,0,1]=4 143 B13R0.165 CCCCCCC(O)CCCCCC CNP0082295.0 [1,1,0,0,0,0|1,0,1]=4 144 B13R0.336 CCC#CC=CCCCCCCCC CNP0611343.0 [1,1,0,0,0,0|1,0,1]=4 145 B13R0.336 CCC=CCCCCCCCCCC CNP0003426.0 [1,1,0,0,0,0|1,0,1]=4 146 B13R0.336 CCC=CCCCCCCCCCO CNP0173162.0 [1,1,0,0,0,0|1,0,1]=4 147 B13R0.336 CCCC=CCCCCCCCCC CNP0541639.0 [1,1,0,0,0,0|1,0,0]=3 148 B13R0.336 CCCCC=CCCCCCCCC CNP0076420.0 [1,1,0,0,0,0|1,0,0]=3 149 B13R0.336 CCCCC=CCCCCCCCO CNP0171301.0 [1,1,0,0,0,0|2,0,0]=4 150 B13R0.336 CCCCCCCCC=CCCC=O CNP0003281.0 [1,1,0,0,0,0|1,0,1]=4 151 B13R0.336 CCCCCCCCC=CCCCO CNP0351626.0 [1,1,0,0,0,0|1,0,0]=3 152 B13R0.336 CCCCCCCCCCCCCC CNP0293304.0 [1,1,0,0,0,0|1,0,1]=4 153 B13R0.336 CCCCCCCCCCCCCI CNP0486092.0 [1,1,0,0,0,0|1,0,1]=4 154 B13R0.336 CCCCCCCCCCCCCN CNP0561220.0 [1,1,0,0,0,0|1,0,1]=4 155 B13R0.336 CCCCCCCCCCCCCO CNP0139347.0 [1,1,0,0,0,0|1,0,1]=4 156 B13R0.338 CCCCCCCC(=O)OCCCC CNP0213733.0 [1,1,0,0,0,0|0,0,2]=4 157 B13R0.338 CCCCCCCC(N)CCCCC CNP0427184.0 [1,1,0,0,0,0|1,0,1]=4 158 B13R0.338 CCCCCCC[C@H](C)CCCCC CNP0183278.1 [1,1,0,0,0,0|1,0,1]=4 159 B13R0.150 CCCCCCCCCC(=O)N(C)C CNP0080141.0 [1,1,0,0,0,0|2,0,0]=4 160 B13R0.150 CCCCCCCCOC(=O)C(C)C CNP0205183.0 [1,1,0,0,0,0|0,0,0]=2 161 B13R0.274 CCCCCCC[C@@H](O)CC(=O)SC CNP0526799.1 [1,1,0,0,0,0|2,0,0]=4 162 B13R0.274 CCCCCCC[C@H](O)CC(=O)OC CNP0172127.1 [1,1,0,0,0,0|2,0,0]=4 163 B15R0.244 CCCCCC(=O)CCCCC(=O)OCC CNP0208298.0 [0,2,0,0,0,0|2,0,0]=4 164 B15R0.324 CCCCCCCCCOC(=O)[C@H](C)CC CNP0326716.1 [0,2,0,0,0,0|0,0,0]=2 165 B15R0.69 CCCCCCCCCOC(=O)CC(C)C CNP0002721.0 [0,2,0,0,0,0|0,0,0]=2 166 B15R0.69 CCCCCCCCCOS(=O)OC(C)C CNP0075943.0 [0,2,0,0,0,0|2,0,0]=4 167 B15R0.3221 CCCCCCCCCC(=O)O[C@H](C)CC CNP0297370.1 [0,2,0,0,0,0|1,0,0]=3 168 B15R0.366 CCCCCCCCCC=CC(=O)OCC CNP0203006.0 [0,2,0,0,0,0|2,0,0]=4 169 B15R0.366 CCCCCCCCCCCC(=O)CCO CNP0280181.0 [0,2,0,0,0,0|2,0,0]=4 170 B15R0.366 CCCCCCCCCCCC(=O)NCC CNP0001305.0 [0,2,0,0,0,0|2,0,0]=4 171 B15R0.366 CCCCCCCCCCCC(=O)OCC CNP0263071.0 [0,2,0,0,0,0|2,0,0]=4 172 B15R0.366 CCCCCCCCCCOC(=O)CCC CNP0186393.0 [0,2,0,0,0,0|0,0,0]=2 173 B15R0.366 CCOC(=O)CCCCCCCCCC=O CNP0279106.0 [0,2,0,0,0,0|2,0,0]=4 174 B15R0.110 C=C(C)CCCC(C)CCOC(=O)CCC CNP0002842.0 [0,2,0,0,0,0|0,0,1]=3 175 B15R0.110 CCCC(=O)OCC[C@H](C)CCC=C(C)C CNP0359188.1 [0,2,0,0,0,0|0,0,2]=4 176 B15R0.88 CCCCCCCC=CC(=O)NCC(C)C CNP0201035.0 [0,2,0,0,0,0|1,0,1]=4 177 B15R0.88 CCCCCCCCCC(=O)NCC(C)C CNP0308804.0 [0,2,0,0,0,0|1,0,0]=3 178 B15R0.88 CCCCCCCCCC(=O)OCC(C)C CNP0076649.0 [0,2,0,0,0,0|1,0,0]=3 179 B15R0.88 CCCCCCCCOC(=O)CCC(C)C CNP0541657.0 [0,2,0,0,0,0|0,0,0]=2 180 B15R0.322 CCCCCC(=O)OCCCOCCCC CNP0222713.0 [0,2,0,0,0,0|1,0,0]=3 181 B15R0.322 CCCCCCC=COC(=O)CCCCC CNP0519859.0 [0,2,0,0,0,0|0,0,2]=4 182 B15R0.322 CCCCCCCC=CC(=O)OCCCC CNP0002822.0 [0,2,0,0,0,0|1,0,1]=4 183 B15R0.322 CCCCCCCCCC(=O)OCCCC CNP0288450.0 [0,2,0,0,0,0|1,0,0]=3 184 B15R0.322 CCCCCCCCOC(=O)CCCCC CNP0294728.0 [0,2,0,0,0,0|0,0,0]=2 185 B15R0.322 CCCCOC(=O)CCCCCCCCO CNP0299327.0 [0,2,0,0,0,0|2,0,0]=4 186 B13R1.6 CCC=CCCC1CCCC(=O)O1 CNP0119575.0 [1,0,0,1,0,0|0,0,2]=4 187 B13R1.6 CCCCCCC1CCCC(=O)O1 CNP0280779.0 [1,0,0,1,0,0|0,0,0]=2 188 B13R1.6 CCCCCCC1COCC(=O)O1 CNP0002639.0 [1,0,0,1,0,0|1,0,0]=3 189 B13R1.42 CCOC(=O)CCC1CCCCC1 CNP0003502.0 [1,0,0,1,0,0|1,0,0]=3 190 B13R1.119 CCCCCCCCC1CCCC1 CNP0080496.0 [1,0,0,1,0,0|1,0,1]=4 191 B13R1.190 CCCCCCC1OC(=O)CC1C CNP0251689.0 [1,0,0,1,0,0|0,0,0]=2 192 B13R1.190 CCCCCC[C@@H]1CC(=O)CC1=O CNP0252659.1 [1,0,0,1,0,0|1,0,1]=4 193 B13R1.279 O=C1CCCCCCCCCCC1 CNP0294882.0 [1,0,0,1,0,0|0,0,0]=2 194 B13R1.279 O=C1CCCCCCCCCCO1 CNP0348572.0 [1,0,0,1,0,0|0,0,0]=2 195 B13R1.279 OC1CCCCCCCCCCC1 CNP0367434.0 [1,0,0,1,0,0|0,0,2]=4 196 B13R1.470 CCCC(=O)C[C@H]1CCCCN1C CNP0304537.1 [1,0,0,1,0,0|1,0,0]=3 197 B13R1.654 CCCCCCCC1CCCC1=O CNP0079998.0 [1,0,0,1,0,0|0,0,0]=2 198 B13R1.3821 CC1CCCCCCC(=O)OC1C CNP0207162.0 [1,0,0,1,0,0|1,0,0]=3 199 B13R1.28 CCCCCCCC1CCCCC1 CNP0076836.0 [1,0,0,1,0,0|1,0,1]=4 200 B13R1.2883 C1CCCCCCCCCCCC1 CNP0566911.0 [1,0,0,1,0,0|1,0,1]=4 201 B13R1.9 CCCCCCC1COC(=O)CO1 CNP0002636.0 [1,0,0,1,0,0|1,0,0]=3 202 B13R1.27 CCCCCCCC1C=CC(=O)O1 CNP0546311.0 [1,0,0,1,0,0|0,0,2]=4 203 B13R1.27 CCCCCCC[C@@H]1CCC(=O)O1 CNP0201617.2 [1,0,0,1,0,0|0,0,0]=2 204 B13R1.27 CCCCCCC[C@H]1CCC(=O)O1 CNP0201617.1 [1,0,0,1,0,0|0,0,0]=2 205 B15R1.942 CCC(C)CCCCC1CCCC(=O)O1 CNP0351135.0 [0,1,0,1,0,0|0,0,0]=2 206 B15R1.1010 CCCCCCC[C@@H]1C[C@H](CC(=O)O1)O CNP0545694.1 [0,1,0,1,0,0|0,0,0]=2 207 B15R1.5737 C[C@@H]1CCCCCCCCCCC(=O)C1 CNP0104860.1 [0,1,0,1,0,0|1,0,0]=3 208 B15R1.5737 C[C@@H]1CCCCCCCCCCC(=O)O1 CNP0233115.1 [0,1,0,1,0,0|0,0,0]=2 209 B15R1.253 N[C@H]1CCCCCCCCCCNC1=O CNP0547506.1 [0,1,0,1,0,0|1,0,0]=3 210 B15R1.5365 CCCCC/C=C\C[C@@H]1OC(=O)C[C@H]1C CNP0222757.1 [0,1,0,1,0,0|0,0,1]=3 211 B15R1.5365 CCCCCCCC[C@@H]1CC(=O)CC1=O CNP0321800.1 [0,1,0,1,0,0|1,0,1]=4 212 B15R1.35 CCCCCCCCCC1=NCCCC1 CNP0450651.0 [0,1,0,1,0,0|2,0,0]=4 213 B15R1.6476 O=C1CCCCCCCC(=O)OCCO1 CNP0319407.0 [0,1,0,1,0,0|1,0,1]=4 214 B15R1.106 CCCCCCCCC1CCCC(=O)O1 CNP0174932.0 [0,1,0,1,0,0|0,0,0]=2 215 B15R1.6595 O=C1C=CCCCCCCCCCCC1 CNP0071987.0 [0,1,0,1,0,0|1,0,0]=3 216 B15R1.6595 O=C1CCCC=CCCCCCCCC1 CNP0321790.0 [0,1,0,1,0,0|1,0,1]=4 217 B15R1.6595 O=C1CCCCCCCCCCCCC1 CNP0211498.0 [0,1,0,1,0,0|1,0,0]=3 218 B15R1.6595 O=C1CCCCCCCCCCCCO1 CNP0407259.0 [0,1,0,1,0,0|0,0,0]=2 219 B15R1.119 C[C@@H](O)CCCCC[C@@H]1CC=CC(=O)O1 CNP0234475.1 [0,1,0,1,0,0|0,0,2]=4 220 B15R2.42187 O=C1CCC[C@@]2([C@@H]1CCCCCC2)O CNP0321411.1 [0,0,0,2,0,0|2,0,0]=4 221 B15R2.47582 O=C1CCCC2(CCCCC2CC1)O CNP0556230.0 [0,0,0,2,0,0|2,0,0]=4