0 B11R1.222 CCC(C)C1=C(CCCO1)C CNP0344911.0 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.222 CCC(C)C1CCCCC1=O CNP0002485.0 [0,0,0,0,0,0|0,0,0]=0 2 B10R1.4 CCCC1CCCCC1C CNP0605780.0 [1,0,0,0,0,0|1,0,1]=3 3 B10R1.4 CCCC1CCCOC1=O CNP0416617.0 [1,0,0,0,0,0|1,0,0]=2 4 B10R1.4 CCC[C@@H]1CCCCN1C CNP0256186.1 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.4 CCC[C@H]1CCCCN1C CNP0256186.2 [1,0,0,0,0,0|2,0,0]=3 6 B10R1.4 COCC1CCCC[C@@H]1N CNP0344437.1 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.15 CCC(=O)C1CCCCN1 CNP0080269.0 [1,0,0,0,0,0|2,0,1]=4 8 B10R1.15 CC[C@@H](O)[C@@H]1CCCCN1 CNP0379746.1 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.61 C=C(C)C1CCCCC1=C CNP0547861.0 [1,0,0,0,0,0|1,0,2]=4 10 B10R1.61 CC(=C1CCCCC1=O)C CNP0262850.0 [1,0,0,0,0,0|0,0,2]=3 11 B10R1.61 CC(C)C1CCCCC1=O CNP0486183.0 [1,0,0,0,0,0|0,0,0]=1 12 B10R1.61 CC(C)C1OCCNC1=O CNP0105827.0 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.61 CC(C)[C@@H]1CCCC[C@@H]1O CNP0289802.3 [1,0,0,0,0,0|0,0,2]=3 14 B10R1.61 CC(C)[C@@H]1CCCC[C@H]1O CNP0289802.4 [1,0,0,0,0,0|0,0,2]=3 15 B10R1.61 CC(C)[C@H]1CCCC[C@@H]1O CNP0289802.2 [1,0,0,0,0,0|0,0,2]=3 16 B10R1.61 CC(C)[C@H]1CCCC[C@H]1O CNP0289802.1 [1,0,0,0,0,0|0,0,2]=3 17 B10R1.61 CC1=C(CCCN1)C(C)C CNP0333659.0 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.61 CC1=C(CCCO1)C(C)C CNP0344846.0 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.61 CC1=C(CCNC1)C(C)C CNP0384615.0 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.61 CC1=C(CCOC1)C(C)C CNP0355159.0 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.61 CC1=C(CCSC1)C(C)C CNP0305631.0 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.61 CC1=C(COCC1)C(C)C CNP0300903.0 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.61 CC1=C(CSCC1)C(C)C CNP0153341.0 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.61 CC1=C(NCCC1)C(C)C CNP0344848.0 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.61 CC1=C(SCCC1)C(C)C CNP0344856.0 [1,0,0,0,0,0|2,0,1]=4 26 B12R1.354 CC[C@H](C)[C@@H]1NC(=O)CNC1=O CNP0465201.1 [0,1,0,0,0,0|2,0,1]=4 27 B10R0.18 CCCCC(=O)CC(=O)OC CNP0554371.0 [0,0,1,0,0,0|2,0,1]=4 28 B10R0.30 CCCC(C(=O)O)C(O)CC CNP0562011.0 [0,0,1,0,0,0|2,0,0]=3 29 B10R0.35 CCOC(=O)C(O)C(C)CC CNP0296108.0 [0,0,1,0,0,0|2,0,0]=3 30 B10R0.74 C=CCCCCCC(C)CC CNP0564356.0 [0,0,1,0,0,0|1,0,0]=2 31 B10R0.74 CCCCCCCC(C)OC CNP0223394.0 [0,0,1,0,0,0|2,0,1]=4 32 B10R0.74 CCCCCCCC(Cl)CC CNP0573579.0 [0,0,1,0,0,0|2,0,1]=4 33 B10R0.74 CCCCCCC[C@@H](C)CC CNP0202505.2 [0,0,1,0,0,0|1,0,1]=3 34 B10R0.74 CCCCCCC[C@@H](O)CC CNP0233369.2 [0,0,1,0,0,0|2,0,1]=4 35 B10R0.74 CCCCCCC[C@H](C)CC CNP0202505.1 [0,0,1,0,0,0|1,0,1]=3 36 B10R0.74 CCCCCCC[C@H](O)CC CNP0233369.1 [0,0,1,0,0,0|2,0,1]=4 37 B12R2.203 C[C@@H]1CC[C@H]2[C@@H]1C(=O)OCC2 CNP0118821.1 [0,0,0,1,0,0|1,0,0]=2 38 B12R2.203 C[C@H]1CC[C@H]2[C@@H]1C(=O)OCC2 CNP0118821.2 [0,0,0,1,0,0|1,0,0]=2 39 B12R2.1081 CC1CCCC2C1CCCC2 CNP0271648.0 [0,0,0,1,0,0|1,0,1]=3 40 B12R2.1081 C[C@H]1CCC[N+]2=C1CCCC2 CNP0514960.1 [0,0,0,1,0,0|2,0,1]=4 41 B12R2.1081 N[C@H]1CCC[C@H]2[C@@H]1CCCC2 CNP0128742.1 [0,0,0,1,0,0|2,0,1]=4 42 B12R2.1540 CCC(=O)C12CC1COC2=O CNP0604116.0 [0,0,0,1,0,0|2,0,1]=4 43 B12R2.7539 CC1=CC[C@H]2C[C@@H]1[C@@]2(C)CO CNP0153154.2 [0,0,0,1,0,0|2,0,1]=4 44 B12R2.7539 CC1=CC[C@H]2C[C@@H]1[C@]2(C)CO CNP0153154.1 [0,0,0,1,0,0|2,0,1]=4 45 B10R1.149 CCC(C)C1CCCC1=O CNP0505342.0 [0,0,0,0,1,0|0,0,0]=1 46 B10R1.149 O=C1CCCN1C(P)CP CNP0217897.0 [0,0,0,0,1,0|3,0,0]=4 47 B9R0.4 CCCCC(=O)C=C(C)C CNP0611962.0 [1,0,1,0,0,0|0,0,2]=4 48 B9R0.4 CCCCC(=O)CC(=O)C CNP0579463.0 [1,0,1,0,0,0|1,0,1]=4 49 B9R0.4 CCCCC(=O)OC(C)C CNP0348909.0 [1,0,1,0,0,0|1,0,0]=3 50 B9R0.4 CCCC[C@@H](O)CC(C)C CNP0080555.1 [1,0,1,0,0,0|0,0,2]=4 51 B9R0.4 CCCC[C@H](O)CC(C)C CNP0080555.2 [1,0,1,0,0,0|0,0,2]=4 52 B9R0.4 CCCOC(=O)CC(C)C CNP0105828.0 [1,0,1,0,0,0|1,0,0]=3 53 B9R0.18 CCCCC(=O)CCCC CNP0611710.0 [1,0,1,0,0,0|0,0,0]=2 54 B9R0.18 CCCCC(=O)OCCC CNP0084151.0 [1,0,1,0,0,0|1,0,0]=3 55 B9R0.18 CCCCP(=O)CCCC CNP0029890.0 [1,0,1,0,0,0|1,0,0]=3 56 B9R0.18 CCCC[S+]([O-])CCCC CNP0610540.0 [1,0,1,0,0,0|1,0,1]=4 57 B9R0.34 CCCC(=O)OC(C)CC CNP0531548.0 [1,0,1,0,0,0|1,0,0]=3 58 B9R0.34 CCCC(C)CC(C)CC CNP0083059.0 [1,0,1,0,0,0|1,0,1]=4 59 B9R0.34 CCOC(=O)CC(C)SC CNP0019037.0 [1,0,1,0,0,0|2,0,0]=4 60 B9R0.34 CCOC(=O)C[C@@H](O)CC CNP0017829.1 [1,0,1,0,0,0|2,0,0]=4 61 B9R0.34 CCOC(=O)C[C@H](C)CC CNP0112934.1 [1,0,1,0,0,0|1,0,0]=3 62 B9R0.46 CCCCCCC(C)CO CNP0611666.0 [1,0,1,0,0,0|1,0,1]=4 63 B9R0.46 CCCCCC[C@@H](C)CC CNP0315749.1 [1,0,1,0,0,0|0,0,1]=3 64 B9R0.46 CCCCCC[C@@H](O)CC CNP0164339.1 [1,0,1,0,0,0|1,0,1]=4 65 B9R0.46 CCCCCC[C@H](C)OC CNP0198435.1 [1,0,1,0,0,0|1,0,1]=4 66 B9R0.46 CCCCCC[C@H](O)CC CNP0164339.2 [1,0,1,0,0,0|1,0,1]=4 67 B9R0.46 CC[C@H](C)CCCCCO CNP0220176.1 [1,0,1,0,0,0|0,0,1]=3 68 B9R0.12 C=CCC(CC)C(=O)CC CNP0001522.0 [1,0,1,0,0,0|0,0,2]=4 69 B9R0.15 CCCC(CCC)C(=O)N CNP0104978.0 [1,0,1,0,0,0|1,0,0]=3 70 B9R0.15 CCCC(CCC)C(=O)O CNP0384704.0 [1,0,1,0,0,0|1,0,0]=3 71 B9R0.15 CCCC(CCC)C(=O)[O-] CNP0581160.0 [1,0,1,0,0,0|1,0,0]=3 72 B9R0.15 CCCC(CCC)C(=O)[O-] CNP0588550.0 [1,0,1,0,0,0|1,0,0]=3 73 B9R0.29 CCC(C)C(CC)C(=O)N CNP0490151.0 [1,0,1,0,0,0|1,0,0]=3 74 B9R0.29 CC[C@@H](C)[C@@H](NC)C(=O)O CNP0218334.2 [1,0,1,0,0,0|2,0,0]=4 75 B9R0.29 CC[C@@H](C)[C@H](NC)C(=O)O CNP0218334.4 [1,0,1,0,0,0|2,0,0]=4 76 B9R0.29 CC[C@H](C)[C@@H](NC)C(=O)O CNP0218334.1 [1,0,1,0,0,0|2,0,0]=4 77 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O CNP0218334.3 [1,0,1,0,0,0|2,0,0]=4 78 B9R0.29 CN[C@H](C(=O)OC)C(C)C CNP0088244.1 [1,0,1,0,0,0|2,0,0]=4 79 B9R0.33 CCCC(C(=O)O)C(C)C CNP0499654.0 [1,0,1,0,0,0|1,0,0]=3 80 B9R0.6 CCOC(=O)C(C)C(C)S CNP0164740.0 [1,0,1,0,0,0|2,0,0]=4 81 B9R0.6 CCOC(=O)[C@@H](N)C(C)C CNP0535653.1 [1,0,1,0,0,0|2,0,0]=4 82 B9R0.6 CCOC(=O)[C@H](O)C(C)C CNP0170066.1 [1,0,1,0,0,0|2,0,0]=4 83 B9R0.8 CCCCC(C)C(C)CC CNP0516887.0 [1,0,1,0,0,0|0,0,1]=3 84 B9R0.8 CCCC[C@@H](O)[C@H](C)CC CNP0267749.1 [1,0,1,0,0,0|0,0,1]=3 85 B9R0.8 CCCC[C@H](O)[C@@H](C)CC CNP0267749.2 [1,0,1,0,0,0|0,0,1]=3 86 B9R0.8 CCCOC(=O)[C@H](C)CC CNP0204627.1 [1,0,1,0,0,0|1,0,1]=4 87 B9R0.27 CCC(=O)C(=O)C(C)CC CNP0330922.0 [1,0,1,0,0,0|1,0,1]=4 88 B9R0.27 CCC(=O)[C@@H](C)[C@@H](O)CC CNP0412913.2 [1,0,1,0,0,0|1,0,0]=3 89 B9R0.27 CCC(=O)[C@H](C)[C@H](O)CC CNP0412913.1 [1,0,1,0,0,0|1,0,0]=3 90 B9R0.27 CC[C@@H](O)[C@@H](C)C(=O)OC CNP0229138.1 [1,0,1,0,0,0|2,0,0]=4 91 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC CNP0385653.2 [1,0,1,0,0,0|2,0,0]=4 92 B9R0.27 CC[C@H](C)[C@H](O)C(=O)OC CNP0192892.1 [1,0,1,0,0,0|2,0,0]=4 93 B9R0.35 CCCC(=O)C(=O)CCC CNP0333081.0 [1,0,1,0,0,0|1,0,1]=4 94 B9R0.35 CCCC(=O)C(O)CCC CNP0003366.0 [1,0,1,0,0,0|1,0,0]=3 95 B9R0.35 CCC[C@@H](O)[C@@H](C)CCC CNP0244344.1 [1,0,1,0,0,0|0,0,2]=4 96 B9R0.35 CCC[C@H](C)C(=O)OCC CNP0333238.1 [1,0,1,0,0,0|1,0,0]=3 97 B9R0.2 CC(C)CCCCCC=O CNP0541884.0 [1,0,1,0,0,0|0,0,0]=2 98 B9R0.2 CCCCCCCC(C)C CNP0389961.0 [1,0,1,0,0,0|1,0,1]=4 99 B9R0.45 C#CCCCCCCCC CNP0272182.0 [1,0,1,0,0,0|1,0,1]=4 100 B9R0.45 C=CCCCCCCCC CNP0330037.0 [1,0,1,0,0,0|1,0,0]=3 101 B9R0.45 C=CCCCCCCCO CNP0326407.0 [1,0,1,0,0,0|2,0,0]=4 102 B9R0.45 CCC=CCCCCC=O CNP0136988.0 [1,0,1,0,0,0|0,0,2]=4 103 B9R0.45 CCCCC=CCCC=O CNP0314028.0 [1,0,1,0,0,0|0,0,2]=4 104 B9R0.45 CCCCCC=CCC=O CNP0158662.0 [1,0,1,0,0,0|0,0,2]=4 105 B9R0.45 CCCCCCC=CC=O CNP0163216.0 [1,0,1,0,0,0|0,0,2]=4 106 B9R0.45 CCCCCCCC=C=O CNP0527715.0 [1,0,1,0,0,0|0,0,2]=4 107 B9R0.45 CCCCCCCC=CO CNP0085832.0 [1,0,1,0,0,0|0,0,2]=4 108 B9R0.45 CCCCCCCCC#N CNP0309769.0 [1,0,1,0,0,0|1,0,1]=4 109 B9R0.45 CCCCCCCCC=O CNP0328165.0 [1,0,1,0,0,0|0,0,0]=2 110 B9R0.45 CCCCCCCCCC CNP0279708.0 [1,0,1,0,0,0|1,0,1]=4 111 B9R0.45 CCCCCCCCCI CNP0565198.0 [1,0,1,0,0,0|1,0,1]=4 112 B9R0.45 CCCCCCCCCO CNP0307663.0 [1,0,1,0,0,0|0,0,2]=4 113 B9R0.45 CCCCCCCCOC CNP0305574.0 [1,0,1,0,0,0|2,0,0]=4 114 B9R0.45 CCCCCCCNC=O CNP0503918.0 [1,0,1,0,0,0|1,0,0]=3 115 B9R0.45 CCCCCCCOC=O CNP0272781.0 [1,0,1,0,0,0|1,0,0]=3 116 B9R0.45 NCCCNCCCC=O CNP0100864.0 [1,0,1,0,0,0|2,0,0]=4 117 B9R0.13 CCCCC(CC)C(C)C CNP0593985.0 [1,0,1,0,0,0|1,0,1]=4 118 B9R0.40 CCCCC(CC)CCC CNP0569100.0 [1,0,1,0,0,0|1,0,1]=4 119 B9R1.8 CCCC1=CCCCC1 CNP0080648.0 [2,0,0,0,0,0|0,0,1]=3 120 B9R1.8 CCCC1=NCCCC1 CNP0295908.0 [2,0,0,0,0,0|1,0,1]=4 121 B9R1.8 CCCC1CCCCC1 CNP0158548.0 [2,0,0,0,0,0|0,0,1]=3 122 B9R1.8 CCCN1CCCCC1 CNP0186645.0 [2,0,0,0,0,0|1,0,1]=4 123 B9R1.8 CCC[C@@H]1CCCCN1 CNP0295617.2 [2,0,0,0,0,0|1,0,0]=3 124 B9R1.8 CCC[C@H]1CCCCN1 CNP0295617.1 [2,0,0,0,0,0|1,0,0]=3 125 B9R1.8 NCCC1CCCCC1 CNP0424532.0 [2,0,0,0,0,0|1,0,1]=4 126 B9R1.8 NCCC1CCCCN1 CNP0503669.0 [2,0,0,0,0,0|2,0,0]=4 127 B9R1.8 OCCC1C=CCCC1 CNP0071903.0 [2,0,0,0,0,0|1,0,1]=4 128 B9R1.8 OCC[C@@H]1CCCCN1 CNP0378251.2 [2,0,0,0,0,0|2,0,0]=4 129 B9R1.8 OCC[C@H]1CCCCN1 CNP0378251.1 [2,0,0,0,0,0|2,0,0]=4 130 B9R1.15 CC[C@@H]1CCCCC1=O CNP0225469.1 [2,0,0,0,0,0|0,0,0]=2 131 B9R1.15 CC[C@H]1CCCC[C@H]1C CNP0240068.1 [2,0,0,0,0,0|1,0,1]=4 132 B9R1.15 CO[C@@H]1CCCCC1=O CNP0076472.1 [2,0,0,0,0,0|1,0,0]=3 133 B9R1.15 CO[C@H]1CCCCC1=O CNP0076472.2 [2,0,0,0,0,0|1,0,0]=3 134 B9R1.15 O=C1COCCC1CO CNP0612158.0 [2,0,0,0,0,0|2,0,0]=4 135 B9R1.6 CC(C)C1CCCCC1 CNP0137845.0 [2,0,0,0,0,0|0,0,1]=3 136 B9R1.6 CC(C)N1CCCCC1 CNP0270932.0 [2,0,0,0,0,0|1,0,1]=4 137 B11R0.5 CCCCC(C)CC(C)CCC CNP0574073.0 [0,1,1,0,0,0|1,0,1]=4 138 B11R0.83 CCC(C)(C)CC(=O)NCCS CNP0344318.0 [0,1,1,0,0,0|2,0,0]=4 139 B11R0.93 CSC(C)CC(=O)OCC(C)C CNP0003257.0 [0,1,1,0,0,0|2,0,0]=4 140 B11R0.44 CCCC(C(=O)C)C(O)C(C)C CNP0504119.0 [0,1,1,0,0,0|1,0,0]=3 141 B11R0.66 CCC(C)C(C)C(C)C(C)CC CNP0559284.0 [0,1,1,0,0,0|1,0,1]=4 142 B11R0.122 CCOC(=O)C(Br)C(C)(O)CC CNP0499844.0 [0,1,1,0,0,0|2,0,0]=4 143 B11R0.116 CCC(C)C(NC)C(=O)C(C)C CNP0344753.0 [0,1,1,0,0,0|1,0,0]=3 144 B11R0.4 C=CCCCCCC(C)CCC CNP0085749.0 [0,1,1,0,0,0|1,0,0]=3 145 B11R0.4 CCCCCCCC(C)CCC CNP0333661.0 [0,1,1,0,0,0|1,0,1]=4 146 B11R0.40 C/C=C/CCCCC[C@H](C)CC CNP0099624.1 [0,1,1,0,0,0|1,0,0]=3 147 B11R0.40 CCC=CCCCCC(C)CC CNP0546883.0 [0,1,1,0,0,0|1,0,1]=4 148 B11R0.40 CCCCCCCC[C@H](C)CC CNP0096496.1 [0,1,1,0,0,0|1,0,1]=4 149 B11R0.42 CCCCCCCC(C)C(C)C CNP0351892.0 [0,1,1,0,0,0|1,0,1]=4 150 B11R0.70 CCCCC(C)CCC(C)CC CNP0547533.0 [0,1,1,0,0,0|1,0,1]=4 151 B11R0.106 CCC(C)CCCCC(C)CC CNP0584422.0 [0,1,1,0,0,0|1,0,1]=4 152 B11R0.111 CC[C@@H](C)CCCCC[C@@H](C)O CNP0340083.1 [0,1,1,0,0,0|0,0,2]=4 153 B11R0.111 CC[C@@H](C)CCCCC[C@H](C)O CNP0340083.2 [0,1,1,0,0,0|0,0,2]=4 154 B11R0.111 CC[C@H](C)CCCCC[C@H](C)O CNP0340083.3 [0,1,1,0,0,0|0,0,2]=4 155 B11R0.111 CC[C@H](O)CCCCCC(=O)O CNP0179017.1 [0,1,1,0,0,0|1,0,0]=3 156 B11R0.174 CCCC(C)CCCC(C)CC CNP0076780.0 [0,1,1,0,0,0|1,0,1]=4 157 B11R1.17 CC#CC[C@H]1CCCCC1=O CNP0076380.1 [1,1,0,0,0,0|0,0,1]=3 158 B11R1.17 CC=CCC1CCCCC1=O CNP0520836.0 [1,1,0,0,0,0|0,0,1]=3 159 B11R1.17 CCNC=C1CCCCC1=O CNP0145902.0 [1,1,0,0,0,0|0,0,2]=4 160 B11R1.17 N#CCC[C@@H]1CCCCC1=O CNP0389654.1 [1,1,0,0,0,0|0,0,1]=3 161 B11R1.17 N#CCC[C@H]1CCCCC1=O CNP0389654.2 [1,1,0,0,0,0|0,0,1]=3 162 B11R1.41 CCCC1CCCCC1CC CNP0083068.0 [1,1,0,0,0,0|1,0,1]=4 163 B11R1.81 CCC[C@H]1CCC(CN1C)O CNP0258006.3 [1,1,0,0,0,0|2,0,0]=4 164 B11R1.81 CCC[C@H]1CC[C@@H](CN1C)O CNP0258006.1 [1,1,0,0,0,0|2,0,0]=4 165 B11R1.81 CCC[C@H]1CC[C@H](CN1C)O CNP0258006.2 [1,1,0,0,0,0|2,0,0]=4 166 B11R1.81 CCC[C@H]1CC[C@H](C[C@H]1O)C CNP0095708.1 [1,1,0,0,0,0|0,0,2]=4 167 B11R1.86 CC(C)C=C1CCCCC1=O CNP0492949.0 [1,1,0,0,0,0|0,0,2]=4 168 B11R1.86 C[C@H](O)C[C@@H]1CCCCN1C CNP0332204.2 [1,1,0,0,0,0|2,0,0]=4 169 B11R1.86 C[C@H](O)C[C@H]1CCCCN1C CNP0332204.1 [1,1,0,0,0,0|2,0,0]=4 170 B11R1.191 CCC[C@@H]1CCCC[N+]1(C)C CNP0422167.1 [1,1,0,0,0,0|2,0,0]=4 171 B11R1.191 CCC[C@H]1CCCC[N+]1(C)C CNP0422167.2 [1,1,0,0,0,0|2,0,0]=4 172 B11R1.774 O=C1CCCC[C@@]1(O)CCO CNP0106385.1 [1,1,0,0,0,0|1,0,0]=3 173 B11R1.16 CCCN(C)C1CCCCC1 CNP0578480.0 [1,1,0,0,0,0|1,0,1]=4 174 B11R1.16 CNCC(C)C1CCCCC1 CNP0279026.0 [1,1,0,0,0,0|0,0,1]=3 175 B11R1.22 CC1CC=C(CC1)C(C)CO CNP0612011.0 [1,1,0,0,0,0|1,0,1]=4 176 B11R1.22 C[C@@H](CO)[C@H]1CC[C@@H](CC1)C CNP0163573.4 [1,1,0,0,0,0|1,0,1]=4 177 B11R1.22 C[C@@H](CO)[C@H]1CC[C@H](CC1)C CNP0163573.2 [1,1,0,0,0,0|1,0,1]=4 178 B11R1.22 C[C@H](CO)[C@H]1CC[C@@H](CC1)C CNP0163573.3 [1,1,0,0,0,0|1,0,1]=4 179 B11R1.22 C[C@H](CO)[C@H]1CC[C@H](CC1)C CNP0163573.1 [1,1,0,0,0,0|1,0,1]=4 180 B11R1.36 CC(C)[C@@H](O)[C@@H]1C=CCCC1 CNP0053771.1 [1,1,0,0,0,0|1,0,1]=4 181 B11R1.36 CC(C)[C@@H](O)[C@H]1C=CCCC1 CNP0053771.3 [1,1,0,0,0,0|1,0,1]=4 182 B11R1.36 CC(C)[C@H](O)[C@@H]1C=CCCC1 CNP0053771.2 [1,1,0,0,0,0|1,0,1]=4 183 B11R1.36 CC(C)[C@H](O)[C@H]1C=CCCC1 CNP0053771.4 [1,1,0,0,0,0|1,0,1]=4 184 B11R1.87 C[Si](C)(C)N1CCCCC1=O CNP0251834.0 [1,1,0,0,0,0|1,1,0]=4 185 B11R1.156 C=C1CCCC(C1C(C)C)O CNP0481534.0 [1,1,0,0,0,0|1,0,0]=3 186 B11R1.166 C=C(C)[C@@H]1CC[C@@H](CC1=O)C CNP0179926.4 [1,1,0,0,0,0|0,0,2]=4 187 B11R1.166 C=C(C)[C@@H]1CC[C@H](CC1=O)C CNP0179926.1 [1,1,0,0,0,0|0,0,2]=4 188 B11R1.166 C=C(C)[C@H]1CC[C@@H](CC1=O)C CNP0179926.2 [1,1,0,0,0,0|0,0,2]=4 189 B11R1.166 C=C(C)[C@H]1CC[C@H](CC1=O)C CNP0179926.3 [1,1,0,0,0,0|0,0,2]=4 190 B11R1.166 CC(=C1CC[C@@H](CC1=O)C)C CNP0270635.2 [1,1,0,0,0,0|0,0,2]=4 191 B11R1.166 CC(=C1CC[C@H](CC1=O)C)C CNP0270635.1 [1,1,0,0,0,0|0,0,2]=4 192 B11R1.166 CC(=O)[C@@H]1CC[C@@H](CC1=O)C CNP0076630.1 [1,1,0,0,0,0|1,0,1]=4 193 B11R1.166 CC(C)C1=CC[C@@H](CC1=O)C CNP0370138.1 [1,1,0,0,0,0|0,0,2]=4 194 B11R1.166 CC(C)C1CC[C@H](CC1=O)C CNP0219935.2 [1,1,0,0,0,0|0,0,0]=2 195 B11R1.166 CC(C)[C@@H]1C=C[C@H](CC1=O)C CNP0154586.1 [1,1,0,0,0,0|0,0,2]=4 196 B11R1.166 CC(C)[C@@H]1CC[C@@H](CC1=O)C CNP0219935.5 [1,1,0,0,0,0|0,0,0]=2 197 B11R1.166 CC(C)[C@@H]1CC[C@@H](C[C@@H]1O)C CNP0243697.8 [1,1,0,0,0,0|0,0,2]=4 198 B11R1.166 CC(C)[C@@H]1CC[C@@H](C[C@H]1O)C CNP0243697.9 [1,1,0,0,0,0|0,0,2]=4 199 B11R1.166 CC(C)[C@@H]1CC[C@H](CC1=O)C CNP0219935.1 [1,1,0,0,0,0|0,0,0]=2 200 B11R1.166 CC(C)[C@@H]1CC[C@H](C[C@@H]1O)C CNP0243697.5 [1,1,0,0,0,0|0,0,2]=4 201 B11R1.166 CC(C)[C@@H]1CC[C@H](C[C@H]1O)C CNP0243697.6 [1,1,0,0,0,0|0,0,2]=4 202 B11R1.166 CC(C)[C@H]1CC[C@@H](CC1=O)C CNP0219935.3 [1,1,0,0,0,0|0,0,0]=2 203 B11R1.166 CC(C)[C@H]1CC[C@@H](C[C@@H]1O)C CNP0243697.7 [1,1,0,0,0,0|0,0,2]=4 204 B11R1.166 CC(C)[C@H]1CC[C@@H](C[C@H]1O)C CNP0243697.4 [1,1,0,0,0,0|0,0,2]=4 205 B11R1.166 CC(C)[C@H]1CC[C@H](CC1=O)C CNP0219935.4 [1,1,0,0,0,0|0,0,0]=2 206 B11R1.166 CC(C)[C@H]1CC[C@H](CC1O)C CNP0243697.3 [1,1,0,0,0,0|0,0,2]=4 207 B11R1.166 CC(C)[C@H]1CC[C@H](C[C@@H]1O)C CNP0243697.10 [1,1,0,0,0,0|0,0,2]=4 208 B11R1.166 CC(C)[C@H]1CC[C@H](C[C@H]1O)C CNP0243697.1 [1,1,0,0,0,0|0,0,2]=4 209 B11R1.166 CC1=CC(=O)[C@@H](CC1)C(C)C CNP0256270.1 [1,1,0,0,0,0|0,0,2]=4 210 B11R1.166 CC1=CC(=O)[C@H](CC1)C(C)C CNP0256270.2 [1,1,0,0,0,0|0,0,2]=4 211 B11R1.166 CC1=CC[C@H](C(=O)C1)C(C)C CNP0354398.1 [1,1,0,0,0,0|0,0,2]=4 212 B11R1.166 CC1C=C(C(CC1)C(C)C)O CNP0003486.0 [1,1,0,0,0,0|0,0,2]=4 213 B11R1.166 CC1CCC(=C(C1)O)C(C)C CNP0029188.0 [1,1,0,0,0,0|0,0,2]=4 214 B11R1.166 CC1CCC(C(=S)C1)C(C)C CNP0266622.0 [1,1,0,0,0,0|0,1,0]=3 215 B11R1.166 CC1CC[C@@H]([C@H](C1)O)C(C)C CNP0243697.2 [1,1,0,0,0,0|0,0,2]=4 216 B13R1.91 CC[C@H](C)C[C@@H]1CCCCN1CC CNP0323159.1 [0,1,0,0,0,1|2,0,0]=4 217 B13R1.4183 CSC(C)(C)[C@@H]1CC[C@@H](CC1=O)C CNP0234484.1 [0,2,0,0,0,0|1,0,0]=3 218 B13R1.4183 CSC(C)(C)[C@H]1CC[C@@H](CC1=O)C CNP0234484.2 [0,2,0,0,0,0|1,0,0]=3 219 B11R1.672 C[C@@H]1C[C@H](N([C@H]1C)C)C(=O)O CNP0138865.1 [0,0,1,1,0,0|2,0,0]=4 220 B11R1.32 C[C@@H]1[C@@H]([C@H](C(=O)O[C@@H]1C)C)O CNP0311543.2 [0,0,1,1,0,0|2,0,0]=4 221 B11R1.32 C[C@@H]1[C@@H]([C@H](C(=O)O[C@H]1C)C)O CNP0311543.1 [0,0,1,1,0,0|2,0,0]=4 222 B11R1.46 CCCCCCCC1CC1C CNP0575710.0 [0,0,1,1,0,0|1,0,1]=4 223 B11R1.101 CC1CCCCCCCCC1 CNP0242949.0 [0,0,1,1,0,0|1,0,1]=4 224 B11R1.18 CCCCC1CCCC1CC CNP0603151.0 [0,0,1,1,0,0|1,0,1]=4 225 B11R2.20 C1CCC2=C(C1)CCCC2 CNP0246589.0 [1,0,0,1,0,0|1,0,1]=4 226 B11R2.20 C1CC[C@@H]2NCCC[C@H]2C1 CNP0425638.1 [1,0,0,1,0,0|1,0,1]=4 227 B11R2.20 C1CC[C@H]2CCCC[C@@H]2C1 CNP0397862.1 [1,0,0,1,0,0|1,0,1]=4 228 B11R2.20 C1CC[C@H]2NCCC[C@H]2C1 CNP0425638.2 [1,0,0,1,0,0|1,0,1]=4 229 B11R2.106 O=C1CCCC2=C1CCC2 CNP0190267.0 [1,0,0,1,0,0|0,0,2]=4 230 B11R2.106 O=C1CCCC2C1=CCC2 CNP0500543.0 [1,0,0,1,0,0|0,0,2]=4 231 B11R2.1 O[C@@H]1CCN2[C@H]1CCCC2 CNP0315202.1 [1,0,0,1,0,0|2,0,0]=4 232 B11R2.533 C=C1CCC2C[C@@H]1C2(C)C CNP0210402.1 [1,0,0,1,0,0|1,0,0]=3 233 B11R2.533 C=C1CC[C@@H]2CC1C2(C)C CNP0210402.2 [1,0,0,1,0,0|1,0,0]=3 234 B11R2.533 C=C1CC[C@@H]2C[C@H]1C2(C)C CNP0210402.4 [1,0,0,1,0,0|1,0,0]=3 235 B11R2.533 C=C1CC[C@H]2C[C@@H]1C2(C)C CNP0210402.3 [1,0,0,1,0,0|1,0,0]=3 236 B11R2.533 CC1([C@@H]2CCC(=O)[C@H]1C2)C CNP0141735.2 [1,0,0,1,0,0|0,0,0]=2 237 B11R2.533 CC1([C@H]2CCC(=O)[C@@H]1C2)C CNP0141735.1 [1,0,0,1,0,0|0,0,0]=2 238 B11R2.533 CC1=C2CC(C2(C)C)CC1 CNP0596283.0 [1,0,0,1,0,0|1,0,1]=4 239 B11R2.533 CC1=CC[C@@H]2C[C@H]1C2(C)C CNP0203449.1 [1,0,0,1,0,0|1,0,1]=4 240 B11R2.533 CC1=CC[C@H]2CC1C2(C)C CNP0203449.3 [1,0,0,1,0,0|1,0,1]=4 241 B11R2.533 CC1=CC[C@H]2C[C@@H]1C2(C)C CNP0203449.2 [1,0,0,1,0,0|1,0,1]=4 242 B11R2.533 C[C@H]1CC[C@@H]2C[C@@H]1C2(C)C CNP0170599.1 [1,0,0,1,0,0|1,0,1]=4 243 B11R2.533 C[C@H]1CC[C@H]2C[C@@H]1C2(C)C CNP0170599.2 [1,0,0,1,0,0|1,0,1]=4 244 B11R2.732 C=C1C[C@@H]2CC[C@H]1C2(C)C CNP0324529.1 [1,0,0,1,0,0|1,0,0]=3 245 B11R2.732 C=C1C[C@H]2CC[C@@H]1C2(C)C CNP0324529.2 [1,0,0,1,0,0|1,0,0]=3 246 B11R2.732 CC1([C@@H]2CC[C@H]1[C@@H](C2)O)C CNP0048179.2 [1,0,0,1,0,0|0,0,2]=4 247 B11R2.732 CC1([C@H]2CC[C@@H]1[C@@H](C2)O)C CNP0048179.1 [1,0,0,1,0,0|0,0,2]=4 248 B11R2.732 CC1=CC2CCC1C2(C)C CNP0135245.0 [1,0,0,1,0,0|1,0,1]=4 249 B13R2.369 CC1CC2CCCCC2CC1C CNP0612116.0 [0,0,0,1,0,1|1,0,1]=4 250 B13R2.4934 C[C@H]1O[C@@H]2CCC(=O)[C@@H](C2)[C@@H]1O CNP0355053.1 [0,1,0,1,0,0|1,0,0]=3 251 B13R2.13186 C=C1[C@H]2CCC[C@]1(OC[C@@H]2C)C CNP0418593.1 [0,1,0,1,0,0|2,0,0]=4 252 B13R2.32 CC1CCC2CCCCC2C1C CNP0612003.0 [0,1,0,1,0,0|1,0,1]=4 253 B13R2.1613 BrC[C@@H]1CCCN2[C@@H]1CCCC2 CNP0365284.2 [0,1,0,1,0,0|2,0,0]=4 254 B13R2.1613 ClC[C@@H]1CCCN2[C@@H]1CCCC2 CNP0143894.1 [0,1,0,1,0,0|2,0,0]=4 255 B13R2.1613 NC[C@@H]1CCCN2[C@@H]1CCCC2 CNP0394740.1 [0,1,0,1,0,0|2,0,0]=4 256 B13R2.1613 OC[C@@H]1CCCN2[C@@H]1CCCC2 CNP0164185.1 [0,1,0,1,0,0|2,0,0]=4 257 B13R2.1613 OC[C@@H]1CCCN2[C@H]1CCCC2 CNP0164185.6 [0,1,0,1,0,0|2,0,0]=4 258 B13R2.1613 OC[C@H]1CCCN2C1CCCC2 CNP0164185.2 [0,1,0,1,0,0|2,0,0]=4 259 B13R2.1613 OC[C@H]1CCCN2[C@@H]1CCCC2 CNP0164185.4 [0,1,0,1,0,0|2,0,0]=4 260 B13R2.1613 OC[C@H]1CCCN2[C@H]1CCCC2 CNP0164185.5 [0,1,0,1,0,0|2,0,0]=4 261 B13R2.1613 SC[C@@H]1CCCN2[C@@H]1CCCC2 CNP0369134.1 [0,1,0,1,0,0|2,0,0]=4 262 B13R2.2931 CCC1CC(=O)C2=C1CCCN2 CNP0002628.0 [0,1,0,1,0,0|1,0,1]=4 263 B13R2.4856 C[C@@H]1[C@@H]2C(=O)OCC[C@H]2C[C@@H]1O CNP0240454.2 [0,1,0,1,0,0|1,0,0]=3 264 B13R2.4856 C[C@@H]1[C@H]2C(=O)OCC[C@H]2C[C@@H]1O CNP0240454.1 [0,1,0,1,0,0|1,0,0]=3 265 B13R2.4856 C[C@H]1[C@@H]2C(=O)OCC[C@@H]2C[C@H]1O CNP0240454.3 [0,1,0,1,0,0|1,0,0]=3 266 B13R2.168 CC1CCCCC12CCCC2C CNP0608480.0 [0,1,0,1,0,0|1,0,1]=4 267 B13R2.3696 C=C1CC([C@@H]2COC([C@@H]1C2)C)C CNP0338101.1 [0,1,0,1,0,0|2,0,0]=4 268 B13R2.4818 CC1C=CCC2C1C(=O)CCC2 CNP0604523.0 [0,1,0,1,0,0|0,0,1]=3 269 B13R2.5151 C=C1COC(=O)[C@H]2[C@@H]1CC[C@@H]2C CNP0273766.1 [0,1,0,1,0,0|1,0,1]=4 270 B13R2.5151 C[C@@H]1COC(=O)[C@@H]2[C@@H]1CC[C@@H]2C CNP0142997.5 [0,1,0,1,0,0|1,0,0]=3 271 B13R2.5151 C[C@@H]1COC(=O)[C@@H]2[C@H]1CC[C@@H]2C CNP0142997.6 [0,1,0,1,0,0|1,0,0]=3 272 B13R2.5151 C[C@@H]1COC(=O)[C@H]2[C@@H]1CC[C@@H]2C CNP0142997.3 [0,1,0,1,0,0|1,0,0]=3 273 B13R2.5151 C[C@@H]1COC(=O)[C@H]2[C@H]1CC[C@@H]2C CNP0142997.4 [0,1,0,1,0,0|1,0,0]=3 274 B13R2.5151 C[C@H]1COC(=O)[C@@H]2[C@@H]1CC[C@@H]2C CNP0142997.2 [0,1,0,1,0,0|1,0,0]=3 275 B13R2.5151 C[C@H]1COC(=O)[C@H]2[C@@H]1CC[C@@H]2C CNP0142997.1 [0,1,0,1,0,0|1,0,0]=3 276 B13R2.5179 C[C@@H]1CC[C@@H]2[C@H](C1)CCC[C@H]2C CNP0269172.1 [0,1,0,1,0,0|1,0,1]=4 277 B9R1.11 CCC(C)C1=COCC1 CNP0578836.0 [1,0,0,0,1,0|1,0,1]=4 278 B9R1.11 CCC(C)C1C=COC1 CNP0612000.0 [1,0,0,0,1,0|1,0,1]=4 279 B9R1.11 CCC(C)C1OCCO1 CNP0407840.0 [1,0,0,0,1,0|2,0,0]=4 280 B9R1.11 CCC(O)C1CCCC1 CNP0577832.0 [1,0,0,0,1,0|1,0,0]=3 281 B9R1.41 CC(C)[C@@H]1CCCC1=O CNP0314072.2 [1,0,0,0,1,0|0,0,0]=2 282 B9R1.41 CC(C)[C@H]1CCCC1=O CNP0314072.1 [1,0,0,0,1,0|0,0,0]=2