0 B10R0.3 C=C(C)CCCC(=C)CCO CNP0253659.0 [0,0,0,0,0,0|0,0,4]=4 1 B10R0.3 C=C(C)CCCC(=CC=O)C CNP0211980.0 [0,0,0,0,0,0|0,0,4]=4 2 B10R0.3 C=C(C)CCC[C@@H](C)CCO CNP0312650.2 [0,0,0,0,0,0|0,0,4]=4 3 B10R0.3 C=C(C)CCC[C@H](C)CCO CNP0312650.1 [0,0,0,0,0,0|0,0,4]=4 4 B10R0.3 C=C(CCO)CCC=C(C)C CNP0106271.0 [0,0,0,0,0,0|0,0,2]=2 5 B10R0.3 C=C(CCO)CCCC(C)C CNP0310766.0 [0,0,0,0,0,0|0,0,4]=4 6 B10R0.3 C=CC=C(C)CCC=C(C)C CNP0134363.0 [0,0,0,0,0,0|1,0,1]=2 7 B10R0.3 C=CCC(C)CCC=C(C)C CNP0086074.0 [0,0,0,0,0,0|1,0,3]=4 8 B10R0.3 CC(=CC#CC(=CC=O)C)C CNP0208098.0 [0,0,0,0,0,0|0,0,4]=4 9 B10R0.3 CC(=CC=CC(=CC=O)C)C CNP0319558.0 [0,0,0,0,0,0|0,0,4]=4 10 B10R0.3 CC(=CC=CC(=CCO)C)C CNP0278603.0 [0,0,0,0,0,0|0,0,2]=2 11 B10R0.3 CC(=CCC=C(C)CC=O)C CNP0267301.0 [0,0,0,0,0,0|0,0,4]=4 12 B10R0.3 CC(=CCC=C(C)CCO)C CNP0086431.0 [0,0,0,0,0,0|0,0,2]=2 13 B10R0.3 CC(=CCCC(=CC#N)C)C CNP0222289.0 [0,0,0,0,0,0|1,0,1]=2 14 B10R0.3 CC(=CCCC(=CC=O)C)C CNP0127332.0 [0,0,0,0,0,0|0,0,2]=2 15 B10R0.3 CC(=CCCC(=CCO)C)C CNP0244258.0 [0,0,0,0,0,0|0,0,0]=0 16 B10R0.3 CC(=CCCC(=CCS)C)C CNP0346825.0 [0,0,0,0,0,0|0,1,0]=1 17 B10R0.3 CC(=CCC[C@@H](C)/C=N\O)C CNP0197332.2 [0,0,0,0,0,0|1,0,1]=2 18 B10R0.3 CC(=CCC[C@@H](C)CC=O)C CNP0348470.1 [0,0,0,0,0,0|0,0,4]=4 19 B10R0.3 CC(=CCC[C@@H](C)CCO)C CNP0152105.1 [0,0,0,0,0,0|0,0,2]=2 20 B10R0.3 CC(=CCC[C@@H](C)NC=O)C CNP0392877.1 [0,0,0,0,0,0|1,0,3]=4 21 B10R0.3 CC(=CCC[C@H](C)/C=N/O)C CNP0197332.1 [0,0,0,0,0,0|1,0,1]=2 22 B10R0.3 CC(=CCC[C@H](C)CC=O)C CNP0348470.2 [0,0,0,0,0,0|0,0,4]=4 23 B10R0.3 CC(=CCC[C@H](C)CCO)C CNP0152105.2 [0,0,0,0,0,0|0,0,2]=2 24 B10R0.3 CC(=CCC[C@H](C)NC=O)C CNP0392877.2 [0,0,0,0,0,0|1,0,3]=4 25 B10R0.3 CC(=CCO)CCCC(C)C CNP0076235.0 [0,0,0,0,0,0|0,0,2]=2 26 B10R0.3 CC(C)CCC[C@@H](C)CCO CNP0232963.2 [0,0,0,0,0,0|0,0,4]=4 27 B10R0.3 CC(C)CCC[C@H](C)CCO CNP0232963.1 [0,0,0,0,0,0|0,0,4]=4 28 B9R0.1 C=C(C)CCCC(C)CO CNP0345669.0 [1,0,0,0,0,0|0,0,3]=4 29 B9R0.1 C=C(CC)CCC=C(C)C CNP0507875.0 [1,0,0,0,0,0|0,0,2]=3 30 B9R0.1 C=CC(=C)CCC=C(C)C CNP0241365.0 [1,0,0,0,0,0|0,0,2]=3 31 B9R0.1 C=CC(=CCC=C(C)C)C CNP0295010.0 [1,0,0,0,0,0|0,0,2]=3 32 B9R0.1 C=C[C@@H](C)CCC=C(C)C CNP0168256.2 [1,0,0,0,0,0|0,0,2]=3 33 B9R0.1 C=C[C@H](C)CCC=C(C)C CNP0168256.1 [1,0,0,0,0,0|0,0,2]=3 34 B9R0.1 CC(=CCCC(=NO)C)C CNP0212502.0 [1,0,0,0,0,0|1,0,0]=2 35 B9R0.1 CC(=CCC[C@@H](C)C=O)C CNP0150075.2 [1,0,0,0,0,0|0,0,2]=3 36 B9R0.1 CC(=CCC[C@@H](C)CO)C CNP0191212.1 [1,0,0,0,0,0|0,0,1]=2 37 B9R0.1 CC(=CCC[C@H](C)C=O)C CNP0150075.1 [1,0,0,0,0,0|0,0,2]=3 38 B9R0.1 CC(=O)C=CC=C(C)CO CNP0040353.0 [1,0,0,0,0,0|1,0,2]=4 39 B9R0.1 CC(=O)CCC=C(C)CO CNP0278208.0 [1,0,0,0,0,0|1,0,2]=4 40 B9R0.1 CC(=O)OCC=C(C)CO CNP0248303.0 [1,0,0,0,0,0|2,0,1]=4 41 B9R0.1 CC(C)CCC[C@@H](C)CO CNP0195092.1 [1,0,0,0,0,0|0,0,3]=4 42 B9R0.1 CC(C)CCC[C@H](C)CO CNP0195092.2 [1,0,0,0,0,0|0,0,3]=4 43 B9R0.1 CC=C(C)C=CC=C(C)C CNP0248120.0 [1,0,0,0,0,0|0,0,2]=3 44 B9R0.1 CC=C(C)CCC=C(C)C CNP0355870.0 [1,0,0,0,0,0|0,0,0]=1 45 B9R0.1 CNC(C)CCC=C(C)C CNP0500173.0 [1,0,0,0,0,0|1,0,1]=3 46 B9R0.2 C=CC=CCCC=C(C)C CNP0185816.0 [1,0,0,0,0,0|1,0,1]=3 47 B9R0.2 CCC=CCCOC(=O)C CNP0265323.0 [1,0,0,0,0,0|3,0,0]=4 48 B9R0.5 CC=CCCC(=O)CCC CNP0280412.0 [1,0,0,0,0,0|2,0,1]=4 49 B11R0.1 CC(=CC(=O)C=C(C)CCO)C CNP0159846.0 [0,1,0,0,0,0|0,0,3]=4 50 B11R0.6 CC(=CC=CC(=CC(=O)O)C)C CNP0286255.0 [0,1,0,0,0,0|0,0,3]=4 51 B11R0.6 CC(=CCC=C(C)CC(=O)O)C CNP0143090.0 [0,1,0,0,0,0|0,0,3]=4 52 B11R0.6 CC(=CCCC(=CC(=O)O)C)C CNP0281881.0 [0,1,0,0,0,0|0,0,1]=2 53 B11R0.6 CC(=CCCC(=CC(C)O)C)C CNP0116095.0 [0,1,0,0,0,0|0,0,0]=1 54 B11R0.6 CC(=CCC[C@@H](C)CC(=O)O)C CNP0402865.1 [0,1,0,0,0,0|0,0,3]=4 55 B11R0.6 CC(=CCC[C@H](C)CC(=O)O)C CNP0402865.2 [0,1,0,0,0,0|0,0,3]=4 56 B11R0.6 CC(=O)C=C(C)CCC=C(C)C CNP0003286.0 [0,1,0,0,0,0|0,0,2]=3 57 B11R0.6 CC(=O)OCCC(=CC(=O)O)C CNP0373658.0 [0,1,0,0,0,0|2,0,1]=4 58 B11R0.45 CC(=CCCC(=CC=O)C=O)C CNP0296885.0 [0,1,0,0,0,0|0,0,3]=4 59 B11R0.45 CC(=CCCC(=CCCl)CCl)C CNP0218953.0 [0,1,0,0,0,0|1,0,0]=2 60 B11R0.45 CC(=CCCC(=CCO)C=O)C CNP0285397.0 [0,1,0,0,0,0|0,0,1]=2 61 B11R0.45 CC(=CCCC(=CCO)CO)C CNP0331630.0 [0,1,0,0,0,0|0,0,0]=1 62 B11R0.59 CC(=CC[C@@H](O)/C(=C/CO)/C)C CNP0222648.2 [0,1,0,0,0,0|0,0,0]=1 63 B11R0.59 CC(=CC[C@H](O)/C(=C/CO)/C)C CNP0222648.1 [0,1,0,0,0,0|0,0,0]=1 64 B11R0.59 CC(=CC[C@H](O)[C@@H](C)CCO)C CNP0215251.1 [0,1,0,0,0,0|0,0,2]=3 65 B11R0.59 CC(=CC[C@H](O)[C@H](C)CCO)C CNP0215251.2 [0,1,0,0,0,0|0,0,2]=3 66 B11R0.104 CC(=CCCC(C)(O)C=CO)C CNP0554020.0 [0,1,0,0,0,0|0,0,2]=3 67 B11R0.104 CC(=CCC[C@@](C)(O)CCO)C CNP0267487.1 [0,1,0,0,0,0|0,0,2]=3 68 B11R0.141 C=C(C)C(=O)CCC(=CCO)C CNP0611341.0 [0,1,0,0,0,0|0,0,1]=2 69 B11R0.141 C=C(C)[C@H](O)CC/C(=C/CO)/C CNP0323522.1 [0,1,0,0,0,0|0,0,2]=3 70 B11R0.145 C=C(C=O)C(C)CCC=C(C)C CNP0611702.0 [0,1,0,0,0,0|0,0,3]=4 71 B11R0.145 C=C(CCC=C(C)C)[C@@H](O)CO CNP0320269.2 [0,1,0,0,0,0|0,0,2]=3 72 B11R0.145 C=C(CCC=C(C)C)[C@H](O)CO CNP0320269.1 [0,1,0,0,0,0|0,0,2]=3 73 B11R0.145 CC(=CCCC(=C(C)CO)C)C CNP0604483.0 [0,1,0,0,0,0|0,0,0]=1 74 B11R0.147 CC(=CCCC(=CCCO)C)C CNP0346393.0 [0,1,0,0,0,0|0,0,0]=1 75 B11R0.147 COCC=C(C)CCC=C(C)C CNP0517198.0 [0,1,0,0,0,0|0,0,0]=1 76 B11R0.174 C/C(=C\CO)/CCC[C@H](C)CO CNP0299538.1 [0,1,0,0,0,0|0,0,2]=3 77 B11R0.174 C=C(CO)CCCC(=CCO)C CNP0409532.0 [0,1,0,0,0,0|0,0,2]=3 78 B11R0.174 CC(=CCCC(=CC=O)C)C=O CNP0029361.0 [0,1,0,0,0,0|0,0,3]=4 79 B11R0.174 CC(=CCCC(=CC=O)C)CO CNP0245895.0 [0,1,0,0,0,0|0,0,2]=3 80 B11R0.174 CC(=CCCC(=CCO)C)C=O CNP0183503.0 [0,1,0,0,0,0|0,0,1]=2 81 B11R0.174 CC(=CCCC(=CCO)C)CO CNP0284436.0 [0,1,0,0,0,0|0,0,0]=1 82 B11R0.174 CC(=CCCC(C)CCO)CO CNP0579020.0 [0,1,0,0,0,0|0,0,2]=3 83 B11R0.180 CC(=CCO)CCCC(C)(C)O CNP0123113.0 [0,1,0,0,0,0|0,0,2]=3 84 B11R1.90 C=C(C)CC[C@H]1OCC=C1C CNP0290949.1 [0,0,0,1,0,0|0,0,2]=3 85 B11R1.90 CC(=CCC1=C(C=CO1)C)C CNP0224893.0 [0,0,0,1,0,0|0,0,2]=3 86 B11R1.90 CC(=CCC1=C(C=CS1)C)C CNP0298862.0 [0,0,0,1,0,0|0,1,2]=4 87 B11R1.90 CC(=CC[C@@H]1OCC=C1C)C CNP0194798.1 [0,0,0,1,0,0|0,0,0]=1 88 B11R1.90 CC(=CC[C@H]1OCC=C1C)C CNP0194798.2 [0,0,0,1,0,0|0,0,0]=1 89 B11R1.157 CC(=C[C@@H]1CC(=CCO1)C)C CNP0171997.2 [0,0,0,1,0,0|0,0,0]=1 90 B11R1.157 CC(=C[C@@H]1C[C@@H](CCO1)C)C CNP0197945.4 [0,0,0,1,0,0|0,0,2]=3 91 B11R1.157 CC(=C[C@@H]1C[C@H](CCO1)C)C CNP0197945.2 [0,0,0,1,0,0|0,0,2]=3 92 B11R1.157 CC(=C[C@H]1CC(=CCO1)C)C CNP0171997.1 [0,0,0,1,0,0|0,0,0]=1 93 B11R1.157 CC(=C[C@H]1C[C@@H](CCO1)C)C CNP0197945.1 [0,0,0,1,0,0|0,0,2]=3 94 B11R1.157 CC(=C[C@H]1C[C@H](CCO1)C)C CNP0197945.3 [0,0,0,1,0,0|0,0,2]=3 95 B11R1.166 C=C(C)[C@@H]1CCC(=C[C@H]1O)C CNP0337621.2 [0,0,0,1,0,0|0,0,2]=3 96 B11R1.166 C=C(C)[C@H]1CCC(=C[C@@H]1O)C CNP0337621.1 [0,0,0,1,0,0|0,0,2]=3 97 B11R1.166 C=C(C)[C@H]1CCC(=C[C@H]1O)C CNP0337621.3 [0,0,0,1,0,0|0,0,2]=3 98 B11R1.166 CC(=C1CC[C@@H](C[C@H]1O)C)C CNP0199137.2 [0,0,0,1,0,0|0,0,2]=3 99 B11R1.166 CC(=C1CC[C@H](C[C@H]1O)C)C CNP0199137.1 [0,0,0,1,0,0|0,0,2]=3 100 B11R1.166 CC(=O)[C@@H]1CCC(=C[C@H]1C)C CNP0099950.1 [0,0,0,1,0,0|2,0,1]=4 101 B11R1.166 CC1=CC(=O)C(=C(C)C)CC1 CNP0331919.0 [0,0,0,1,0,0|0,0,2]=3 102 B11R1.166 CC1=CC(C(=C(C)C)CC1)O CNP0610425.0 [0,0,0,1,0,0|0,0,0]=1 103 B11R1.166 CC1=C[C@@H](C(=C(C)C)CC1)O CNP0610425.1 [0,0,0,1,0,0|0,0,0]=1 104 B11R1.166 CC1=C[C@@H]([C@@H](CC1)C(C)C)O CNP0246159.3 [0,0,0,1,0,0|0,0,2]=3 105 B11R1.166 CC1=C[C@@H]([C@H](CC1)C(C)C)O CNP0246159.2 [0,0,0,1,0,0|0,0,2]=3 106 B11R1.166 CC1=C[C@H]([C@@H](CC1)C(C)C)O CNP0246159.4 [0,0,0,1,0,0|0,0,2]=3 107 B11R1.166 CC1=C[C@H]([C@H](CC1)C(C)C)O CNP0246159.1 [0,0,0,1,0,0|0,0,2]=3 108 B11R1.172 CC(=CCCC1=COC=C1)C CNP0209969.0 [0,0,0,1,0,0|0,0,2]=3 109 B11R1.172 CC(=CCCC1=CSC=C1)C CNP0148788.0 [0,0,0,1,0,0|0,1,2]=4 110 B11R1.342 CC1(CCCC(=CCO)C1)C CNP0227050.0 [0,0,0,1,0,0|0,0,2]=3 111 B11R1.424 CC1=C(C(CCC1)(C)C)CO CNP0515887.0 [0,0,0,1,0,0|0,0,2]=3 112 B11R1.720 CC(=CC/C=C(\C)/[C@@H]1CO1)C CNP0188396.1 [0,0,0,1,0,0|0,0,2]=3 113 B9R0.48 CC=CC(=CC=C(C)C)C CNP0423070.0 [0,0,0,0,1,0|1,0,2]=4 114 B8R0.7 CC(=CCCCC=O)C CNP0514464.0 [2,0,0,0,0,0|0,0,2]=4 115 B8R0.7 CC=CC=CC=C(C)C CNP0533227.0 [2,0,0,0,0,0|0,0,2]=4 116 B8R0.7 CC=CCC=CC(=O)C CNP0611711.0 [2,0,0,0,0,0|1,0,1]=4 117 B8R0.7 CC=CCCCC(=O)C CNP0074972.0 [2,0,0,0,0,0|1,0,1]=4 118 B8R0.7 CCC=CCCC(=O)C CNP0225225.0 [2,0,0,0,0,0|2,0,0]=4 119 B8R0.7 CCCCCC=C(C)C CNP0153071.0 [2,0,0,0,0,0|0,0,2]=4 120 B8R0.28 C=C(C)C=CCC(=C)C CNP0611898.0 [2,0,0,0,0,0|0,0,2]=4 121 B8R0.28 C=C(C)CCC=C(C)C CNP0075848.0 [2,0,0,0,0,0|0,0,0]=2 122 B8R0.28 C=C(C)CCCC(=O)C CNP0188769.0 [2,0,0,0,0,0|1,0,1]=4 123 B8R0.28 C=C(C)CCOC(=O)C CNP0331473.0 [2,0,0,0,0,0|2,0,0]=4 124 B8R0.28 CC(=CCC=C(C)C)C CNP0564316.0 [2,0,0,0,0,0|0,0,1]=3 125 B8R0.28 CC(=CCC[C@@H](C)O)C CNP0250398.2 [2,0,0,0,0,0|0,0,1]=3 126 B8R0.28 CC(=CCC[C@H](C)O)C CNP0250398.1 [2,0,0,0,0,0|0,0,1]=3 127 B8R0.28 CC(=O)CCC=C(C)C CNP0330890.0 [2,0,0,0,0,0|0,0,1]=3 128 B8R0.28 CC(=O)OCC=C(C)C CNP0164397.0 [2,0,0,0,0,0|1,0,1]=4 129 B8R0.28 CC(=O)SCC=C(C)C CNP0138994.0 [2,0,0,0,0,0|1,0,1]=4 130 B8R0.4 CC=CCCC=CC=O CNP0002598.0 [2,0,0,0,0,0|0,0,2]=4 131 B8R0.4 CC=CCCC=CCO CNP0076887.0 [2,0,0,0,0,0|0,0,0]=2 132 B8R0.4 CC=CCCCCCO CNP0534658.0 [2,0,0,0,0,0|0,0,2]=4 133 B8R0.4 CCC=CCC=CCO CNP0338368.0 [2,0,0,0,0,0|0,0,2]=4 134 B8R0.4 CCCCCC=CCO CNP0113756.0 [2,0,0,0,0,0|0,0,2]=4 135 B10R0.44 C=CC(=C)C[C@@H](O)C=C(C)C CNP0127658.1 [1,1,0,0,0,0|0,0,2]=4 136 B10R0.44 C=CC(=C)C[C@H](O)C=C(C)C CNP0127658.2 [1,1,0,0,0,0|0,0,2]=4 137 B10R0.44 C=CC(=CC(O)C=C(C)C)C CNP0546844.0 [1,1,0,0,0,0|0,0,2]=4 138 B10R0.57 C/C(=C/C[C@@H](O)/C(=C/Cl)/C)/Cl CNP0159027.2 [1,1,0,0,0,0|2,0,0]=4 139 B10R0.57 C/C(=C\C[C@H](O)/C(=C/Cl)/C)/Cl CNP0159027.1 [1,1,0,0,0,0|2,0,0]=4 140 B10R0.57 CC(=CC[C@@H](C)[C@@H](C)CO)C CNP0337818.2 [1,1,0,0,0,0|0,0,1]=3 141 B10R0.57 CC(=CC[C@@H](C)[C@H](C)CO)C CNP0337818.1 [1,1,0,0,0,0|0,0,1]=3 142 B10R0.57 CC(=CC[C@H](C)[C@H](C)CO)C CNP0337818.3 [1,1,0,0,0,0|0,0,1]=3 143 B10R0.59 C=CC(=C)CCC=C(C)CO CNP0275354.0 [1,1,0,0,0,0|0,0,2]=4 144 B10R0.59 C=CC(=C)CCC=C(C)OC CNP0184394.0 [1,1,0,0,0,0|0,0,2]=4 145 B10R0.59 CC=C(C)CCC=C(C)CO CNP0514784.0 [1,1,0,0,0,0|0,0,0]=2 146 B10R0.65 C=CC(C)(C)CCC=C(C)C CNP0174844.0 [1,1,0,0,0,0|0,0,2]=4 147 B10R0.65 C=C[C@@](C)(O)CCC=C(C)C CNP0373115.2 [1,1,0,0,0,0|0,0,2]=4 148 B10R0.65 C=C[C@](C)(O)CCC=C(C)C CNP0373115.1 [1,1,0,0,0,0|0,0,2]=4 149 B10R0.65 CCC(C)(O)CCC=C(C)C CNP0080062.0 [1,1,0,0,0,0|0,0,2]=4 150 B10R0.77 C=CC(=CBr)CCC=C(C)C CNP0258853.0 [1,1,0,0,0,0|0,0,2]=4 151 B10R0.77 C=CC(CO)CCC=C(C)C CNP0602563.0 [1,1,0,0,0,0|0,0,2]=4 152 B10R0.82 C=C(C)C(=O)OCC(=CC)C CNP0299028.0 [1,1,0,0,0,0|1,0,1]=4 153 B10R0.82 CC=C(C)COC(=O)C(C)C CNP0582897.0 [1,1,0,0,0,0|1,0,1]=4 154 B10R0.98 C=C(Br)C(=C)CCC=C(C)C CNP0188908.0 [1,1,0,0,0,0|0,0,2]=4 155 B10R0.98 C=C(C)C(=C)CCC=C(C)C CNP0427549.0 [1,1,0,0,0,0|0,0,1]=3 156 B10R0.98 C=C(Cl)C(=C)CCC=C(C)C CNP0379192.0 [1,1,0,0,0,0|0,0,2]=4 157 B10R0.98 CC(=CCC=C(C)C(=O)O)C CNP0318467.0 [1,1,0,0,0,0|0,0,1]=3 158 B10R0.98 CC(=CCCC(C)C(=O)O)C CNP0436414.0 [1,1,0,0,0,0|0,0,1]=3 159 B10R0.98 CC(=CCC[C@@H](C)[C@@H](C)O)C CNP0325931.3 [1,1,0,0,0,0|0,0,1]=3 160 B10R0.98 CC(=CCC[C@@H](C)[C@H](C)O)C CNP0325931.2 [1,1,0,0,0,0|0,0,1]=3 161 B10R0.98 CC(=CCC[C@H](C)[C@@H](C)O)C CNP0325931.1 [1,1,0,0,0,0|0,0,1]=3 162 B10R0.98 CC(=CCC[C@H](C)[C@H](C)O)C CNP0325931.4 [1,1,0,0,0,0|0,0,1]=3 163 B10R0.55 C=CC(=CCCC=C(C)C)C CNP0181853.0 [1,1,0,0,0,0|1,0,1]=4 164 B10R0.55 CC(=CCCC=C(C)CO)C CNP0180707.0 [1,1,0,0,0,0|0,0,0]=2 165 B10R0.55 CCC(=O)C=CCC=C(C)C CNP0093089.0 [1,1,0,0,0,0|1,0,1]=4 166 B10R0.26 C/C(=C\CO)/C[C@H](N)C(=O)O CNP0197260.1 [0,1,0,0,1,0|2,0,0]=4 167 B12R0.279 CC(=CCO)CCC=C(C)C(=O)O CNP0207274.0 [0,1,0,0,0,1|2,0,0]=4 168 B12R0.140 CC(=CCCC(=CC(C)(C)O)C)C CNP0280928.0 [0,2,0,0,0,0|0,0,0]=2 169 B12R0.140 CC(=CCCC(C)CC(C)(C)O)C CNP0103457.0 [0,2,0,0,0,0|0,0,2]=4 170 B12R0.240 CC(=CCCC(=CC(O)C=O)C)C CNP0611897.0 [0,2,0,0,0,0|0,0,0]=2 171 B12R0.240 COC(=O)C=C(C)CCC=C(C)C CNP0141739.0 [0,2,0,0,0,0|0,0,1]=3 172 B12R0.241 CCC(=CCCC(=CC(=O)O)C)C CNP0527633.0 [0,2,0,0,0,0|0,0,1]=3 173 B12R0.686 CC(=CCCC(=C(C)C(=O)O)C)C CNP0438625.0 [0,2,0,0,0,0|0,0,1]=3 174 B12R0.229 CC(=CCCC(=CCCl)CCl)C=O CNP0184042.0 [0,2,0,0,0,0|1,0,1]=4 175 B12R0.229 CC(=CCCC(=CCCl)CCl)CCl CNP0183499.0 [0,2,0,0,0,0|1,0,0]=3 176 B12R0.229 CC(=CCCC(=CCCl)CCl)CO CNP0248747.0 [0,2,0,0,0,0|1,0,0]=3 177 B12R0.299 C=C(C)[C@@H](O)CC/C(=C\CO)/CO CNP0296871.1 [0,2,0,0,0,0|0,0,2]=4 178 B12R0.299 C=C(C)[C@H](O)CC/C(=C/CO)/CO CNP0296871.2 [0,2,0,0,0,0|0,0,2]=4 179 B12R0.178 C/C(=C\CO)/[C@@H](O)CCC(C)(C)O CNP0159106.1 [0,2,0,0,0,0|0,0,2]=4 180 B12R0.178 C/C(=C\CO)/[C@H](O)CCC(C)(C)O CNP0159106.2 [0,2,0,0,0,0|0,0,2]=4 181 B12R0.193 C/C(=C\C[C@@H](Br)/C(=C/C=O)/C)/CCl CNP0117263.1 [0,2,0,0,0,0|0,0,2]=4 182 B12R0.193 C/C(=C\C[C@H](O)/C(=C/CO)/C)/CO CNP0109703.1 [0,2,0,0,0,0|0,0,0]=2 183 B12R0.331 CCC=CC(C)(O)CCC=C(C)C CNP0500851.0 [0,2,0,0,0,0|1,0,1]=4 184 B12R0.613 CC(=CCC[C@@](C)(O)[C@@H](O)CO)C CNP0086997.3 [0,2,0,0,0,0|0,0,2]=4 185 B12R0.613 CC(=CCC[C@@](C)(O)[C@H](O)CO)C CNP0086997.1 [0,2,0,0,0,0|0,0,2]=4 186 B12R0.613 CC(=CCC[C@](C)(O)[C@@H](O)CO)C CNP0086997.4 [0,2,0,0,0,0|0,0,2]=4 187 B12R0.613 CC(=CCC[C@](C)(O)[C@H](O)CO)C CNP0086997.2 [0,2,0,0,0,0|0,0,2]=4 188 B12R0.79 C=C(CO)C(O)CCC(=CCO)C CNP0306291.0 [0,2,0,0,0,0|0,0,2]=4 189 B12R0.156 C=C(CCC=C(C)CO)C(O)CO CNP0137936.0 [0,2,0,0,0,0|0,0,2]=4 190 B12R0.156 CC(=CCC=C(C)C(O)CO)CO CNP0282207.0 [0,2,0,0,0,0|0,0,2]=4 191 B12R0.44 CC(=CCCC(=CC=C(Br)Br)C)C CNP0081219.0 [0,2,0,0,0,0|1,0,1]=4 192 B12R0.44 CC(=CCCC(C)CCC(=O)O)C CNP0572331.0 [0,2,0,0,0,0|0,0,2]=4 193 B12R0.44 CC(=O)CC=C(C)CCC=C(C)C CNP0460160.0 [0,2,0,0,0,0|0,0,1]=3 194 B12R0.44 CC(=O)OC=C(C)CCC=C(C)C CNP0086373.0 [0,2,0,0,0,0|0,0,2]=4 195 B12R0.233 C=COCC=C(C)CCC=C(C)C CNP0076773.0 [0,2,0,0,0,0|0,0,0]=2 196 B12R0.233 CC(=CCCC(=CCOC=O)C)C CNP0394032.0 [0,2,0,0,0,0|0,0,0]=2 197 B12R0.233 CC(=CCC[C@@H](C)CCOC=O)C CNP0301531.2 [0,2,0,0,0,0|0,0,2]=4 198 B12R0.233 CC(=CCC[C@H](C)CCOC=O)C CNP0301531.1 [0,2,0,0,0,0|0,0,2]=4 199 B12R0.233 CC/C=C/C[C@@H](C)CCC=C(C)C CNP0043813.1 [0,2,0,0,0,0|1,0,1]=4 200 B12R0.233 CC/C=C/C[C@H](C)CCC=C(C)C CNP0043813.2 [0,2,0,0,0,0|1,0,1]=4 201 B12R0.573 C/C(=C\CO)/C/C=C/[C@@](C)(O)CO CNP0171405.1 [0,2,0,0,0,0|0,0,2]=4 202 B12R0.573 C/C(=C\CO)/C/C=C/[C@](C)(O)CO CNP0171405.2 [0,2,0,0,0,0|0,0,2]=4 203 B12R0.573 CC(=CCO)CC=CC(C)(C)OO CNP0218796.0 [0,2,0,0,0,0|0,0,2]=4 204 B10R1.13 C=C(C)C1=CC=C(CC1)C CNP0154651.0 [1,0,0,1,0,0|0,0,2]=4 205 B10R1.13 C=C(C)C1=CCC(=CC1)C CNP0603428.0 [1,0,0,1,0,0|0,0,2]=4 206 B10R1.13 C=C(C)[C@@H]1CC=C(CC1)C CNP0282017.1 [1,0,0,1,0,0|0,0,2]=4 207 B10R1.13 C=C(C)[C@H]1CC=C(CC1)C CNP0282017.2 [1,0,0,1,0,0|0,0,2]=4 208 B10R1.13 CC(=C1C=C[C@@H](CC1)C)C CNP0405385.2 [1,0,0,1,0,0|0,0,2]=4 209 B10R1.13 CC(=C1C=C[C@H](CC1)C)C CNP0405385.1 [1,0,0,1,0,0|0,0,2]=4 210 B10R1.13 CC(=C1CCC(CC1)C)C CNP0245988.0 [1,0,0,1,0,0|0,0,2]=4 211 B10R1.13 CC(=O)C1=CC=C(CC1)C CNP0164378.0 [1,0,0,1,0,0|1,0,1]=4 212 B10R1.13 CC(=O)[C@@H]1CC=C(CC1)C CNP0292588.1 [1,0,0,1,0,0|1,0,1]=4 213 B10R1.13 CC(=O)[C@H]1CC=C(CC1)C CNP0292588.2 [1,0,0,1,0,0|1,0,1]=4 214 B10R1.13 CC1=CC=C(CC1)C(C)C CNP0178656.0 [1,0,0,1,0,0|0,0,2]=4 215 B10R1.13 CC1=CCC(=C(C)C)CC1 CNP0160264.0 [1,0,0,1,0,0|0,0,0]=2 216 B10R1.13 CC1=CCC(=CC1)C(C)C CNP0255720.0 [1,0,0,1,0,0|0,0,2]=4 217 B10R1.13 CC1=CC[C@@H](CC1)C(C)C CNP0188222.2 [1,0,0,1,0,0|0,0,2]=4 218 B10R1.13 CC1=CC[C@@H](CC1)N(C)C CNP0566252.1 [1,0,0,1,0,0|1,0,1]=4 219 B10R1.13 CC1=CC[C@H](CC1)C(C)C CNP0188222.1 [1,0,0,1,0,0|0,0,2]=4 220 B10R1.54 CC(=CC1CCC(C1)C)C CNP0182372.0 [1,0,0,1,0,0|0,0,2]=4 221 B10R1.79 CC1=CCCC(=CCC1)C CNP0612141.0 [1,0,0,1,0,0|0,0,0]=2 222 B10R1.194 CC(C)C1=C(C(=O)CC1)O CNP0240398.0 [1,0,0,1,0,0|1,0,1]=4 223 B10R1.197 CC=C1CCC=C(CC1)C CNP0532842.0 [1,0,0,1,0,0|0,0,0]=2 224 B10R1.377 CC1(CC=CCC1)C=NO CNP0546723.0 [1,0,0,1,0,0|1,0,1]=4 225 B10R1.30 CC1=CC=C(C(=C1)CO)C CNP0281493.0 [0,0,0,1,1,0|0,0,2]=4 226 B10R1.63 CC1=C[C@H](C(CC1)(C)C)O CNP0097325.1 [0,0,0,1,1,0|0,0,1]=3 227 B10R1.113 C=C(C)[C@@H]1CCC=C(C1)C CNP0173733.2 [0,0,0,1,1,0|1,0,1]=4 228 B10R1.113 C=C(C)[C@H]1CCC=C(C1)C CNP0173733.1 [0,0,0,1,1,0|1,0,1]=4 229 B10R1.113 CC1=CCCC(=C(C)C)C1 CNP0195517.0 [0,0,0,1,1,0|1,0,0]=3 230 B12R1.754 CC1=C(C(C[C@H](C1)O)(C)C)CO CNP0161775.1 [0,1,0,1,0,0|0,0,2]=4 231 B12R1.1218 CC1=CC(=O)OC(=C(C)C)CC1 CNP0203820.0 [0,1,0,1,0,0|0,0,1]=3 232 B12R1.252 CC(=CCCC1=CCSSC1)C CNP0200243.0 [0,1,0,1,0,0|0,1,0]=3 233 B12R1.131 CC(=CC[C@@]1(OCC=C1C)O)C CNP0299876.2 [0,1,0,1,0,0|0,0,0]=2 234 B12R1.131 CC(=CC[C@]1(OCC=C1C)O)C CNP0299876.1 [0,1,0,1,0,0|0,0,0]=2 235 B12R1.232 CC1=C[C@@H]([C@@H](C[C@@H]1O)C(C)C)O CNP0272943.6 [0,1,0,1,0,0|0,0,2]=4 236 B12R1.232 CC1=C[C@@H]([C@@H](C[C@H]1O)C(C)C)O CNP0272943.7 [0,1,0,1,0,0|0,0,2]=4 237 B12R1.232 CC1=C[C@@H]([C@H](C[C@@H]1O)C(C)C)O CNP0272943.2 [0,1,0,1,0,0|0,0,2]=4 238 B12R1.232 CC1=C[C@@H]([C@H](C[C@H]1O)C(C)C)O CNP0272943.4 [0,1,0,1,0,0|0,0,2]=4 239 B12R1.232 CC1=C[C@H](C(C[C@H]1O)C(C)C)O CNP0272943.3 [0,1,0,1,0,0|0,0,2]=4 240 B12R1.232 CC1=C[C@H]([C@@H](C[C@H]1O)C(C)C)O CNP0272943.1 [0,1,0,1,0,0|0,0,2]=4 241 B12R1.232 CC1=C[C@H]([C@H](C[C@@H]1O)C(C)C)O CNP0272943.5 [0,1,0,1,0,0|0,0,2]=4 242 B12R1.1580 CC(=CCO)C1CCC(O1)(C)C CNP0235035.0 [0,1,0,1,0,0|0,0,2]=4 243 B12R1.1348 CC(=CCCC(C)(O)C1=CO1)C CNP0559908.0 [0,1,0,1,0,0|0,0,2]=4 244 B12R1.1348 CC(=CCC[C@](C)(O)[C@H]1CO1)C CNP0427753.1 [0,1,0,1,0,0|0,0,2]=4 245 B12R1.1947 CC(=CCCC1(OC1CO)C)C CNP0086338.0 [0,1,0,1,0,0|0,0,2]=4 246 B12R1.264 C=C(C)[C@H](O)CCC1=CCOC1 CNP0264091.1 [0,1,0,1,0,0|0,0,2]=4 247 B12R1.893 CC(=C1CCC(=C(C1=O)O)C)C CNP0304604.0 [0,1,0,1,0,0|0,0,2]=4 248 B12R1.57 CO[C@@H]1C=C(CC[C@@H]1C(C)C)C CNP0305774.1 [0,1,0,1,0,0|0,0,2]=4 249 B12R1.154 CC1=C=CCCCC(=CCC1)C CNP0330302.0 [0,1,0,1,0,0|1,0,0]=3 250 B12R1.154 CC1=CC=CCCC(=CCC1)C CNP0237437.0 [0,1,0,1,0,0|1,0,1]=4 251 B12R1.154 CC1=CCCC(=CCC=CC1)C CNP0326995.0 [0,1,0,1,0,0|1,0,0]=3 252 B12R1.1113 CC1=C(C(CCC1)(C)C)CCO CNP0246858.0 [0,1,0,1,0,0|0,0,2]=4 253 B12R1.743 CC1=C([C@H](CC1)[C@H](C)CO)CO CNP0179944.1 [0,1,0,1,0,0|0,0,2]=4 254 B12R1.126 CC1=CC(C(CC1)C(C)(C)O)O CNP0499112.0 [0,1,0,1,0,0|0,0,2]=4 255 B12R1.890 CC(C)(O)C=CCC1=CCOC1 CNP0304352.0 [0,1,0,1,0,0|0,0,2]=4 256 B12R2.612 C=C1CO[C@H]2[C@@H]1CCC(=C2)C CNP0176741.1 [0,0,0,2,0,0|0,0,2]=4 257 B12R2.612 CC1=C[C@@H]2OCC(=C2CC1)C CNP0342362.2 [0,0,0,2,0,0|0,0,0]=2 258 B12R2.612 CC1=C[C@@H]2OC[C@H]([C@@H]2CC1)C CNP0239881.2 [0,0,0,2,0,0|0,0,2]=4 259 B12R2.612 CC1=C[C@H]2OCC(=C2CC1)C CNP0342362.1 [0,0,0,2,0,0|0,0,0]=2 260 B12R2.612 CC1=C[C@H]2OC[C@@H]([C@H]2CC1)C CNP0239881.1 [0,0,0,2,0,0|0,0,2]=4 261 B12R2.612 CC1=C[C@H]2OC[C@H]([C@@H]2CC1)C CNP0239881.3 [0,0,0,2,0,0|0,0,2]=4 262 B12R2.766 CC1=C[C@@H](C2CC1C2(C)C)O CNP0381465.2 [0,0,0,2,0,0|0,0,2]=4 263 B12R2.766 CC1=C[C@@H]([C@@H]2C[C@H]1C2(C)C)O CNP0381465.3 [0,0,0,2,0,0|0,0,2]=4 264 B12R2.766 CC1=C[C@@H]([C@H]2C[C@@H]1C2(C)C)O CNP0381465.1 [0,0,0,2,0,0|0,0,2]=4 265 B12R2.766 CC1=C[C@H]([C@@H]2C[C@H]1C2(C)C)O CNP0381465.5 [0,0,0,2,0,0|0,0,2]=4 266 B12R2.766 CC1=C[C@H]([C@H]2C[C@@H]1C2(C)C)O CNP0381465.4 [0,0,0,2,0,0|0,0,2]=4 267 B12R2.774 CC1=C[C@@H]([C@@]2([C@H]1C2)C(C)C)O CNP0487175.1 [0,0,0,2,0,0|0,0,2]=4 268 B8R0.9 CC(=NO)CCC(C)C CNP0165038.0 [1,0,0,0,1,0|1,0,1]=4 269 B8R0.9 CC=C(C)CCC(=O)C CNP0152365.0 [1,0,0,0,1,0|1,0,0]=3 270 B8R0.9 CC=C(C)COC(=O)C CNP0535362.0 [1,0,0,0,1,0|2,0,0]=4 271 B8R0.9 CCC(=O)CC=C(C)C CNP0559660.0 [1,0,0,0,1,0|1,0,1]=4 272 B8R0.9 COC(=O)CC=C(C)C CNP0248108.0 [1,0,0,0,1,0|2,0,0]=4