0 B11R1.12 CC=C(C=O)C1=CC=CC=C1 CNP0164159.0 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.12 CCC(CC)C1=CC=CC=C1 CNP0422788.0 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.12 CCN(CC)C1=CC=CC=C1 CNP0287297.0 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.12 CC[NH+](CC)C1=CC=CC=C1 CNP0485521.0 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.12 COC(=NO)C1=CC=CC=C1 CNP0557037.0 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.12 COC(OC)C1=CC=CC=C1 CNP0042286.0 [0,0,0,0,0,0|0,0,0]=0 6 B11R1.12 COP(OC)C1=CC=CC=C1 CNP0049160.0 [0,0,0,0,0,0|1,0,0]=1 7 B11R1.12 CO[C@H](C#N)C1=CC=CC=C1 CNP0186304.1 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.12 CO[PH](OC)C1=CC=CC=C1 CNP0522233.0 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.15 C#CC(O)C1=CC=CC=C1 CNP0086091.0 [1,0,0,0,0,0|1,0,1]=3 10 B10R1.15 C=CC(O)C1=CC=CC=C1 CNP0085682.0 [1,0,0,0,0,0|1,0,1]=3 11 B10R1.15 CC(=NO)C1=CC=CC=C1 CNP0218225.0 [1,0,0,0,0,0|2,0,1]=4 12 B10R1.15 CC(C=O)C1=CC=CC=C1 CNP0070168.0 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.15 CC(NN)C1=CC=CC=C1 CNP0480531.0 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.15 CC=C(C)C1=CC=CC=C1 CNP0250835.0 [1,0,0,0,0,0|1,0,1]=3 15 B10R1.15 CCC(=O)C1=CC=CC=C1 CNP0320895.0 [1,0,0,0,0,0|1,0,2]=4 16 B10R1.15 CCC(C)C1=CC=CC=C1 CNP0037599.0 [1,0,0,0,0,0|1,0,0]=2 17 B10R1.15 CCC(C)C1=CN=CC=N1 CNP0519520.0 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 CNP0437980.1 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 CNP0333746.1 [1,0,0,0,0,0|1,0,0]=2 20 B10R1.15 CC[C@H](N)C1=CC=CC=C1 CNP0437980.2 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.15 CN(C=O)C1=CC=CC=C1 CNP0026033.0 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.15 CNC(=O)C1=CC=CC=C1 CNP0491778.0 [1,0,0,0,0,0|1,0,2]=4 23 B10R1.15 CNC(C)C1=CC=CC=C1 CNP0515964.0 [1,0,0,0,0,0|1,0,0]=2 24 B10R1.15 COC(=O)C1=CC=CC=C1 CNP0233777.0 [1,0,0,0,0,0|0,0,2]=3 25 B10R1.15 COC(=O)C1=CC=CC=N1 CNP0214824.0 [1,0,0,0,0,0|1,0,2]=4 26 B10R1.15 COC(=O)C1=CC=CN=C1 CNP0284518.0 [1,0,0,0,0,0|1,0,2]=4 27 B10R1.15 CO[C@H](C)C1=CC=CC=C1 CNP0170205.1 [1,0,0,0,0,0|0,0,0]=1 28 B10R1.15 CSC(=O)C1=CC=CC=C1 CNP0351124.0 [1,0,0,0,0,0|0,1,2]=4 29 B10R1.15 C[C@@H](C#N)C1=CC=CC=C1 CNP0213613.2 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.15 C[C@@H](CO)C1=CC=CC=C1 CNP0177539.1 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.15 C[C@@H](N=N)C1=CC=CC=C1 CNP0257341.1 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.15 C[C@H](C#N)C1=CC=CC=C1 CNP0213613.1 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.15 N#C[C@@H](O)C1=CC=CC=C1 CNP0193863.2 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.15 N#C[C@H](O)C1=CC=CC=C1 CNP0193863.1 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 CNP0107878.1 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.15 NC[C@H](O)C1=CC=CC=C1 CNP0107878.2 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.15 O=C[C@H](O)C1=CC=CC=C1 CNP0556372.1 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.15 OC=C(O)C1=CC=CC=C1 CNP0119701.0 [1,0,0,0,0,0|2,0,1]=4 39 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 CNP0106512.1 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.15 OC[C@H](O)C1=CC=CC=C1 CNP0106512.2 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.15 O[C@@H](CBr)C1=CC=CC=C1 CNP0028950.2 [1,0,0,0,0,0|2,0,0]=3 42 B10R1.15 O[C@H](CBr)C1=CC=CC=C1 CNP0028950.1 [1,0,0,0,0,0|2,0,0]=3 43 B12R1.3 CCO[C@H](C#N)C1=CC=CC=C1 CNP0140613.1 [0,1,0,0,0,0|2,0,0]=3 44 B12R1.3 CC[C@@H](NC=O)C1=CC=CC=C1 CNP0538754.1 [0,1,0,0,0,0|2,0,1]=4 45 B12R1.12 CO[C@@H](CO)C1=CC=C(C=C1)O CNP0260815.2 [0,1,0,0,0,0|2,0,0]=3 46 B12R1.12 CO[C@H](CO)C1=CC=C(C=C1)O CNP0260815.1 [0,1,0,0,0,0|2,0,0]=3 47 B12R1.13 COC(OC)C1=CC=CC(=C1)C CNP0611238.0 [0,1,0,0,0,0|0,0,0]=1 48 B12R1.243 CCC(CC)C1=CC=CC=C1O CNP0402285.0 [0,1,0,0,0,0|2,0,0]=3 49 B12R1.478 CC(=O)[C@@H](C#N)C1=CC=CC=C1 CNP0076616.1 [0,1,0,0,0,0|3,0,0]=4 50 B12R1.478 CC(C)C(C=O)C1=CC=CC=C1 CNP0415741.0 [0,1,0,0,0,0|3,0,0]=4 51 B12R1.478 CCC(C(=O)N)C1=CC=CC=C1 CNP0569843.0 [0,1,0,0,0,0|3,0,0]=4 52 B12R1.478 CC[C@@H](C(=O)O)C1=CC=CC=C1 CNP0002389.1 [0,1,0,0,0,0|3,0,0]=4 53 B12R1.478 CC[C@H](C(=O)O)C1=CC=CC=C1 CNP0002389.2 [0,1,0,0,0,0|3,0,0]=4 54 B12R1.478 CN[C@@H](C(=O)O)C1=CC=CC=C1 CNP0318350.2 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.478 CN[C@H](C(=O)O)C1=CC=CC=C1 CNP0318350.1 [0,1,0,0,0,0|3,0,0]=4 56 B12R1.478 CO[C@@H](C(=O)O)C1=CC=CC=C1 CNP0291222.2 [0,1,0,0,0,0|2,0,0]=3 57 B12R1.478 CO[C@H](C(=O)Cl)C1=CC=CC=C1 CNP0251789.1 [0,1,0,0,0,0|2,0,0]=3 58 B12R1.478 CO[C@H](C(=O)O)C1=CC=CC=C1 CNP0291222.1 [0,1,0,0,0,0|2,0,0]=3 59 B12R2.1 COC1=CCC2=CC=CC=C12 CNP0054465.0 [0,0,0,1,0,0|1,0,1]=3 60 B12R2.2 C1=CC=C(C=C1)C2=NCCC2 CNP0036375.0 [0,0,0,1,0,0|2,0,1]=4 61 B12R2.2 C1=CN=CC(=C1)[C@@H]2CCCN2 CNP0110438.2 [0,0,0,1,0,0|3,0,0]=4 62 B12R2.2 C1=CN=CC(=C1)[C@H]2CCCN2 CNP0110438.1 [0,0,0,1,0,0|3,0,0]=4 63 B12R1.118 COC(=CC1=CC=CC=C1)C=O CNP0496622.0 [0,0,0,0,0,1|2,0,1]=4 64 B12R1.118 COC(CC1=CC=CC=C1)OC CNP0268816.0 [0,0,0,0,0,1|0,0,0]=1 65 B9R1.6 C=C(C)C1=CC=CC=C1 CNP0080169.0 [2,0,0,0,0,0|0,0,2]=4 66 B9R1.6 CC(=O)C1=CC=CC=C1 CNP0296349.0 [2,0,0,0,0,0|0,0,2]=4 67 B9R1.6 CC(C)C1=CC=CC=C1 CNP0123409.0 [2,0,0,0,0,0|0,0,0]=2 68 B9R1.6 CC(C)C1=CC=CN=C1 CNP0157310.0 [2,0,0,0,0,0|1,0,0]=3 69 B9R1.6 CC(C)C1=CCC=CC1 CNP0531274.0 [2,0,0,0,0,0|0,0,2]=4 70 B9R1.6 CC(C)C1=CN=CC=N1 CNP0293152.0 [2,0,0,0,0,0|2,0,0]=4 71 B9R1.6 CC(O)C1=CN=CC=N1 CNP0588053.0 [2,0,0,0,0,0|2,0,0]=4 72 B9R1.6 CN(C)C1=CC=CC=C1 CNP0137867.0 [2,0,0,0,0,0|1,0,0]=3 73 B9R1.6 CN(C)C1=CC=NC=C1 CNP0362397.0 [2,0,0,0,0,0|2,0,0]=4 74 B9R1.6 C[C@@H](N)C1=CC=CC=C1 CNP0079805.1 [2,0,0,0,0,0|1,0,0]=3 75 B9R1.6 C[C@@H](O)C1=CC=CC=C1 CNP0207239.2 [2,0,0,0,0,0|0,0,0]=2 76 B9R1.6 C[C@H](N)C1=CC=CC=C1 CNP0079805.2 [2,0,0,0,0,0|1,0,0]=3 77 B9R1.6 C[C@H](O)C1=CC=CC=C1 CNP0207239.1 [2,0,0,0,0,0|0,0,0]=2 78 B9R1.6 C[S@@+]([O-])C1=CC=CC=C1 CNP0081847.1 [2,0,0,0,0,0|1,0,1]=4 79 B9R1.6 O=C(O)C1=CC=CC=C1 CNP0136227.0 [2,0,0,0,0,0|0,0,2]=4 80 B9R1.6 O=[S@@](O)C1=CC=CC=C1 CNP0216430.1 [2,0,0,0,0,0|1,0,1]=4 81 B9R1.6 O=[S@](O)C1=CC=CC=C1 CNP0216430.2 [2,0,0,0,0,0|1,0,1]=4 82 B9R1.6 O=[SH](O)C1=CC=CC=C1 CNP0547392.0 [2,0,0,0,0,0|1,0,1]=4 83 B9R1.6 OB(O)C1=CC=CC=C1 CNP0209672.0 [2,0,0,0,0,0|1,0,0]=3 84 B9R1.8 C=CCC1=CC=CC=C1 CNP0286989.0 [2,0,0,0,0,0|1,0,1]=4 85 B9R1.8 CC=CC1=CC=CC=C1 CNP0155788.0 [2,0,0,0,0,0|1,0,1]=4 86 B9R1.8 CCCC1=CC=CC=C1 CNP0279045.0 [2,0,0,0,0,0|1,0,0]=3 87 B9R1.8 CCCC1=CC=CC=N1 CNP0611670.0 [2,0,0,0,0,0|2,0,0]=4 88 B9R1.8 CCCC1=CC=CN=C1 CNP0003440.0 [2,0,0,0,0,0|2,0,0]=4 89 B9R1.8 CCCC1=CC=NC=C1 CNP0509766.0 [2,0,0,0,0,0|2,0,0]=4 90 B9R1.8 CCNC1=CC=CC=C1 CNP0144333.0 [2,0,0,0,0,0|2,0,0]=4 91 B9R1.8 CCOC1=CC=CC=C1 CNP0163447.0 [2,0,0,0,0,0|2,0,0]=4 92 B9R1.8 CNCC1=CC=CC=C1 CNP0335341.0 [2,0,0,0,0,0|1,0,0]=3 93 B9R1.8 COCC1=CC=CC=C1 CNP0244920.0 [2,0,0,0,0,0|0,0,0]=2 94 B9R1.8 CSCC1=CC=CC=C1 CNP0188452.0 [2,0,0,0,0,0|0,1,0]=3 95 B9R1.8 CSSC1=CC=CC=C1 CNP0079617.0 [2,0,0,0,0,0|1,1,0]=4 96 B9R1.8 N#CCC1=CC=CC=C1 CNP0203807.0 [2,0,0,0,0,0|2,0,0]=4 97 B9R1.8 N#[14C]CC1=CC=CC=C1 CNP0479819.0 [2,0,0,0,0,0|2,0,0]=4 98 B9R1.8 NCCC1=CC=CC=C1 CNP0141127.0 [2,0,0,0,0,0|2,0,0]=4 99 B9R1.8 NNCC1=CC=CC=C1 CNP0458353.0 [2,0,0,0,0,0|2,0,0]=4 100 B9R1.8 O=CCC1=CC=CC=C1 CNP0175320.0 [2,0,0,0,0,0|2,0,0]=4 101 B9R1.8 OCCC1=CC=CC=C1 CNP0402269.0 [2,0,0,0,0,0|2,0,0]=4 102 B9R1.8 OSCC1=CC=CC=C1 CNP0050397.0 [2,0,0,0,0,0|1,1,0]=4 103 B9R1.8 SCCC1=CC=CC=C1 CNP0611698.0 [2,0,0,0,0,0|2,0,0]=4 104 B11R1.7 C=CC(C)(O)C1=CC=CC=C1 CNP0570138.0 [1,1,0,0,0,0|1,0,1]=4 105 B11R1.7 CC(C)(CO)C1=CC=CC=C1 CNP0520946.0 [1,1,0,0,0,0|2,0,0]=4 106 B11R1.7 CC(C)(OO)C1=CC=CC=C1 CNP0082560.0 [1,1,0,0,0,0|1,0,0]=3 107 B11R1.7 CC(O)(CO)C1=CC=CC=C1 CNP0122921.0 [1,1,0,0,0,0|2,0,0]=4 108 B11R1.7 C[C@@](N)(CN)C1=CC=CC=C1 CNP0275184.1 [1,1,0,0,0,0|2,0,0]=4 109 B11R1.7 C[C@](N)(C#N)C1=CC=CC=C1 CNP0276998.1 [1,1,0,0,0,0|2,0,0]=4 110 B11R1.16 C=CC[C@@H](O)C1=CC=CC=C1 CNP0109551.2 [1,1,0,0,0,0|1,0,1]=4 111 B11R1.16 C=CC[C@H](O)C1=CC=CC=C1 CNP0109551.1 [1,1,0,0,0,0|1,0,1]=4 112 B11R1.16 CC(CC=O)C1=CC=CC=C1 CNP0079862.0 [1,1,0,0,0,0|1,0,1]=4 113 B11R1.16 CC(OC=O)C1=CC=CC=C1 CNP0002788.0 [1,1,0,0,0,0|0,0,1]=3 114 B11R1.16 CCOC(=O)C1=CC=CC=C1 CNP0341969.0 [1,1,0,0,0,0|0,0,2]=4 115 B11R1.16 CCO[C@H](C)C1=CC=CC=C1 CNP0384490.1 [1,1,0,0,0,0|0,0,0]=2 116 B11R1.16 CCO[C@H](C)C1=CN=CC=N1 CNP0113976.1 [1,1,0,0,0,0|2,0,0]=4 117 B11R1.16 CNC[C@@H](O)C1=CC=CC=C1 CNP0154385.1 [1,1,0,0,0,0|1,0,0]=3 118 B11R1.16 CNC[C@H](O)C1=CC=CC=C1 CNP0154385.2 [1,1,0,0,0,0|1,0,0]=3 119 B11R1.16 COCC(=O)C1=CC=CC=C1 CNP0505302.0 [1,1,0,0,0,0|0,0,2]=4 120 B11R1.16 C[C@@H](N=C=S)C1=CC=CC=C1 CNP0391564.2 [1,1,0,0,0,0|1,0,1]=4 121 B11R1.16 C[C@H](N=C=S)C1=CC=CC=C1 CNP0391564.1 [1,1,0,0,0,0|1,0,1]=4 122 B11R1.16 OCC[C@@H](O)C1=CC=CC=C1 CNP0046660.2 [1,1,0,0,0,0|1,0,0]=3 123 B11R1.16 OCC[C@H](O)C1=CC=CC=C1 CNP0046660.1 [1,1,0,0,0,0|1,0,0]=3 124 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 CNP0602353.1 [1,1,0,0,0,0|1,0,0]=3 125 B11R1.22 C=C[C@@H](O)C1=CC=C(C=C1)O CNP0280373.2 [1,1,0,0,0,0|1,0,1]=4 126 B11R1.22 C=C[C@H](O)C1=CC=C(C=C1)O CNP0280373.1 [1,1,0,0,0,0|1,0,1]=4 127 B11R1.22 CC1=CC=C(C=C1)C(C)C=O CNP0371792.0 [1,1,0,0,0,0|2,0,0]=4 128 B11R1.22 CC1=CC=C(C=C1)[C@H](C)CO CNP0229536.1 [1,1,0,0,0,0|2,0,0]=4 129 B11R1.22 CCC(C)C1=CC=C(C=C1)C CNP0084852.0 [1,1,0,0,0,0|1,0,0]=3 130 B11R1.22 CCC(O)C1=CC=C(C=C1)O CNP0386254.0 [1,1,0,0,0,0|1,0,0]=3 131 B11R1.22 CC[C@@H](C)C1=CC=C(C=C1)O CNP0374132.1 [1,1,0,0,0,0|1,0,0]=3 132 B11R1.22 COC(=O)C1=CC=C(C=C1)C CNP0137727.0 [1,1,0,0,0,0|0,0,2]=4 133 B11R1.22 COC(=O)C1=CC=C(C=C1)N CNP0162858.0 [1,1,0,0,0,0|0,0,2]=4 134 B11R1.22 COC(=O)C1=CC=C(C=C1)O CNP0259416.0 [1,1,0,0,0,0|0,0,2]=4 135 B11R1.22 CO[C@H](C)C1=CC=C(C=C1)O CNP0294754.1 [1,1,0,0,0,0|0,0,0]=2 136 B11R1.22 N#C[C@@H](O)C1=CC=C(C=C1)O CNP0245965.1 [1,1,0,0,0,0|2,0,0]=4 137 B11R1.22 N#C[C@H](O)C1=CC=C(C=C1)O CNP0245965.2 [1,1,0,0,0,0|2,0,0]=4 138 B11R1.22 NC[C@@H](O)C1=CC=C(C=C1)O CNP0139359.1 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.22 NC[C@H](O)C1=CC=C(C=C1)O CNP0139359.2 [1,1,0,0,0,0|2,0,0]=4 140 B11R1.22 OC[C@@H](O)C1=CC=C(C=C1)O CNP0398619.1 [1,1,0,0,0,0|2,0,0]=4 141 B11R1.22 OC[C@H](O)C1=CC=C(C=C1)O CNP0398619.2 [1,1,0,0,0,0|2,0,0]=4 142 B11R1.23 COC(=O)C1=CC=CC(=C1)Br CNP0260377.0 [1,1,0,0,0,0|0,0,2]=4 143 B11R1.23 COC(=O)C1=CC=CC(=C1)C CNP0189828.0 [1,1,0,0,0,0|0,0,2]=4 144 B11R1.23 COC(=O)C1=CC=CC(=C1)N CNP0145729.0 [1,1,0,0,0,0|0,0,2]=4 145 B11R1.23 COC(=O)C1=CC=CC(=C1)O CNP0301417.0 [1,1,0,0,0,0|0,0,2]=4 146 B11R1.23 N#C[C@@H](O)C1=CC=CC(=C1)O CNP0135364.1 [1,1,0,0,0,0|2,0,0]=4 147 B11R1.36 C=C(C)[C@@H](O)C1=CC=CC=C1 CNP0098533.1 [1,1,0,0,0,0|1,0,0]=3 148 B11R1.36 CC(C)[C@@H](C)C1=CC=CC=C1 CNP0042832.2 [1,1,0,0,0,0|1,0,0]=3 149 B11R1.36 CC(C)[C@H](C)C1=CC=CC=C1 CNP0042832.1 [1,1,0,0,0,0|1,0,0]=3 150 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 CNP0224074.1 [1,1,0,0,0,0|2,0,0]=4 151 B11R1.36 C[C@@H](N)[C@@H](O)C1=CC=CC=C1 CNP0148528.2 [1,1,0,0,0,0|1,0,0]=3 152 B11R1.36 C[C@@H](N)[C@H](O)C1=CC=CC=C1 CNP0148528.4 [1,1,0,0,0,0|1,0,0]=3 153 B11R1.36 C[C@@H](O)[C@@H](O)C1=CC=CC=C1 CNP0294274.3 [1,1,0,0,0,0|1,0,0]=3 154 B11R1.36 C[C@@H](O)[C@H](O)C1=CC=CC=C1 CNP0294274.2 [1,1,0,0,0,0|1,0,0]=3 155 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 CNP0224074.2 [1,1,0,0,0,0|2,0,0]=4 156 B11R1.36 C[C@H](N)C(O)[14C]1=[14CH][14CH]=[14CH][14CH]=[14CH]1 CNP0148528.5 [1,1,0,0,0,0|1,0,0]=3 157 B11R1.36 C[C@H](N)[C@@H](O)C1=CC=CC=C1 CNP0148528.1 [1,1,0,0,0,0|1,0,0]=3 158 B11R1.36 C[C@H](N)[C@H](O)C1=CC=CC=C1 CNP0148528.3 [1,1,0,0,0,0|1,0,0]=3 159 B11R1.36 C[C@H](O)[C@@H](O)C1=CC=CC=C1 CNP0294274.1 [1,1,0,0,0,0|1,0,0]=3 160 B11R1.36 C[C@H](O)[C@H](O)C1=CC=CC=C1 CNP0294274.4 [1,1,0,0,0,0|1,0,0]=3 161 B11R1.36 NC(=O)[C@H](O)C1=CC=CC=C1 CNP0213891.1 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 CNP0248394.1 [1,1,0,0,0,0|2,0,0]=4 163 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 CNP0248394.2 [1,1,0,0,0,0|2,0,0]=4 164 B11R1.222 CCC(C)C1=CC=CC=C1O CNP0038393.0 [1,1,0,0,0,0|1,0,0]=3 165 B11R1.222 COC(=O)C1=CC=CC=C1I CNP0211185.0 [1,1,0,0,0,0|0,0,2]=4 166 B11R1.222 COC(=O)C1=CC=CC=C1N CNP0163520.0 [1,1,0,0,0,0|0,0,2]=4 167 B11R1.222 COC(=O)C1=CC=CC=C1O CNP0320906.0 [1,1,0,0,0,0|0,0,2]=4 168 B11R1.222 [11CH3]OC(=O)C1=CC=CC=C1O CNP0584467.0 [1,1,0,0,0,0|0,0,2]=4 169 B13R1.86 CCC(NC)C(=O)C1=CC=CC=C1 CNP0442443.0 [0,1,0,0,0,1|2,0,0]=4 170 B13R1.86 COC(CO)C(=O)C1=CC=CC=C1 CNP0582214.0 [0,1,0,0,0,1|2,0,0]=4 171 B13R1.86 COC(OC)C(C)C1=CC=CC=C1 CNP0091794.0 [0,1,0,0,0,1|0,0,0]=2 172 B13R1.86 COP(OC)C(=O)C1=CC=CC=C1 CNP0040989.0 [0,1,0,0,0,1|1,0,0]=3 173 B13R1.86 CO[PH](OC)C(=O)C1=CC=CC=C1 CNP0503971.0 [0,1,0,0,0,1|1,0,0]=3 174 B13R1.418 CO[C@@H](CC1=CC=CC=C1)C(=O)O CNP0243391.2 [0,1,0,0,0,1|2,0,0]=4 175 B13R1.418 CO[C@H](CC1=CC=CC=C1)C(=O)O CNP0243391.1 [0,1,0,0,0,1|2,0,0]=4 176 B13R1.1 CCOC(CO)C1=CC=C(C=C1)O CNP0609600.0 [0,2,0,0,0,0|2,0,0]=4 177 B13R1.1 CNC[C@H](OC)C1=CC=C(C=C1)O CNP0304927.1 [0,2,0,0,0,0|1,0,0]=3 178 B13R1.26 COCC[C@@H](OC)C1=CC=CC=C1 CNP0070881.2 [0,2,0,0,0,0|0,0,0]=2 179 B13R1.26 COCC[C@H](OC)C1=CC=CC=C1 CNP0070881.1 [0,2,0,0,0,0|0,0,0]=2 180 B13R1.26 COCOC(C=O)C1=CC=CC=C1 CNP0149378.0 [0,2,0,0,0,0|2,0,0]=4 181 B13R1.398 SCOC(OCS)C1=CC=CC=C1 CNP0158444.0 [0,2,0,0,0,0|0,0,0]=2 182 B13R1.402 CNCC(C)(NC)C1=CC=CC=C1 CNP0245548.0 [0,2,0,0,0,0|2,0,0]=4 183 B13R1.405 CCO[C@H](C(=O)O)C1=CC=CC=C1 CNP0224902.1 [0,2,0,0,0,0|2,0,0]=4 184 B13R1.532 CN[C@@H](C(=O)OC)C1=CC=CC=C1 CNP0061519.1 [0,2,0,0,0,0|1,0,0]=3 185 B13R1.532 CN[C@H](C(=O)OC)C1=CC=CC=C1 CNP0061519.2 [0,2,0,0,0,0|1,0,0]=3 186 B13R1.532 COC(=O)[C@@H](OC)C1=CC=CC=C1 CNP0274570.2 [0,2,0,0,0,0|0,0,0]=2 187 B13R1.532 COC(=O)[C@H](CO)C1=CC=CC=C1 CNP0172131.1 [0,2,0,0,0,0|2,0,0]=4 188 B13R1.532 COC(=O)[C@H](OC)C1=CC=CC=C1 CNP0274570.1 [0,2,0,0,0,0|0,0,0]=2 189 B13R1.713 CC(=O)O[C@@H](C#N)C1=CC=CC=C1 CNP0168985.1 [0,2,0,0,0,0|2,0,0]=4 190 B13R1.713 CC(=O)O[C@@H](CO)C1=CC=CC=C1 CNP0137534.1 [0,2,0,0,0,0|2,0,0]=4 191 B13R1.713 CCC(OC(=O)C)C1=CC=CC=C1 CNP0611641.0 [0,2,0,0,0,0|1,0,0]=3 192 B13R1.713 CC[C@@H](NC(=O)C)C1=CC=CC=C1 CNP0144225.2 [0,2,0,0,0,0|2,0,0]=4 193 B13R1.713 CC[C@H](NC(=O)C)C1=CC=CC=C1 CNP0144225.1 [0,2,0,0,0,0|2,0,0]=4 194 B13R1.39 COC1=CC=C(C=C1)C(CO)OC CNP0495050.0 [0,2,0,0,0,0|2,0,0]=4 195 B13R1.39 COC1=CC=C(C=C1)C(OC)OC CNP0234292.0 [0,2,0,0,0,0|0,0,0]=2 196 B13R1.331 COC(OC)C1=CC=C(C(=C1)O)O CNP0129986.0 [0,2,0,0,0,0|0,0,0]=2 197 B13R1.331 CO[C@H](CO)C1=CC=C(C(=C1)O)O CNP0242961.1 [0,2,0,0,0,0|2,0,0]=4 198 B13R1.706 CO[C@@H](C1=CC=C(C=C1)O)[C@H](C)O CNP0141175.1 [0,2,0,0,0,0|1,0,0]=3 199 B13R1.710 CC[C@@](C)(OC)C1=CC=C(C=C1)C CNP0055490.2 [0,2,0,0,0,0|1,0,0]=3 200 B13R1.710 CC[C@](C)(OC)C1=CC=C(C=C1)C CNP0055490.1 [0,2,0,0,0,0|1,0,0]=3 201 B13R1.92 CCC(NC)C1=CC=CC=C1OC CNP0194355.0 [0,2,0,0,0,0|2,0,0]=4 202 B13R1.412 COC(OC)(OC)C1=CC=CC=C1 CNP0611656.0 [0,2,0,0,0,0|0,0,0]=2 203 B11R2.1 CC1=CCC2=CC=CC=C12 CNP0299127.0 [1,0,0,1,0,0|1,0,1]=4 204 B11R2.1 C[C@@H]1C=CC2=CC=CC=C12 CNP0066516.2 [1,0,0,1,0,0|1,0,1]=4 205 B11R2.1 C[C@H]1C=CC2=CC=CC=C12 CNP0066516.1 [1,0,0,1,0,0|1,0,1]=4 206 B11R2.1 C[C@H]1CCC2=CC=CC=C12 CNP0102551.1 [1,0,0,1,0,0|1,0,0]=3 207 B11R2.1 C[C@H]1CCC2=CC=NC=C12 CNP0192635.1 [1,0,0,1,0,0|2,0,0]=4 208 B11R2.1 O=C1OCC2=CC=CC=C12 CNP0263138.0 [1,0,0,1,0,0|0,0,2]=4 209 B11R2.1 OC1=NCC2=CC=CC=C12 CNP0522338.0 [1,0,0,1,0,0|1,0,1]=4 210 B11R2.4 NC1C[C@H]1C2=CC=CC=C2 CNP0337465.1 [1,0,0,1,0,0|2,0,0]=4 211 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 CNP0337465.2 [1,0,0,1,0,0|2,0,0]=4 212 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 CNP0337465.3 [1,0,0,1,0,0|2,0,0]=4 213 B11R2.988 C=C[C@@H]1CC2=CC=CC=C12 CNP0030371.1 [1,0,0,1,0,0|1,0,1]=4 214 B11R2.988 C=C[C@H]1CC2=CC=CC=C12 CNP0030371.2 [1,0,0,1,0,0|1,0,1]=4 215 B11R2.988 N#C[C@@H]1CC2=CC=CC=C12 CNP0391601.2 [1,0,0,1,0,0|2,0,0]=4 216 B11R2.988 N#C[C@H]1CC2=CC=CC=C12 CNP0391601.1 [1,0,0,1,0,0|2,0,0]=4 217 B13R2.3 C1=CC=C(C=C1)C2CCCCC2 CNP0320256.0 [0,1,0,1,0,0|2,0,0]=4 218 B13R2.3 C1=CC=C(C=C1)C2CCCNC2 CNP0501853.0 [0,1,0,1,0,0|2,0,0]=4 219 B13R2.10 CC1COC(O1)C2=CC=CC=C2 CNP0291344.0 [0,1,0,1,0,0|0,0,0]=2 220 B13R2.2931 COC1=C[C@@H](C2=CC=CC=C12)C CNP0046972.1 [0,1,0,1,0,0|1,0,1]=4 221 B13R2.2931 COC1=C[C@H](C2=CC=CC=C12)C CNP0046972.2 [0,1,0,1,0,0|1,0,1]=4 222 B13R2.2931 CO[C@@H]1C=C(C2=CC=CC=C12)C CNP0039873.1 [0,1,0,1,0,0|1,0,0]=3 223 B13R2.2931 CO[C@@H]1OC(=O)C2=CC=CC=C12 CNP0262154.1 [0,1,0,1,0,0|0,0,1]=3 224 B13R2.2931 CO[C@H]1C=C(C2=CC=CC=C12)C CNP0039873.2 [0,1,0,1,0,0|1,0,0]=3 225 B13R2.2931 CO[C@H]1OC(=O)C2=CC=CC=C12 CNP0262154.2 [0,1,0,1,0,0|0,0,1]=3 226 B13R2.135 CO[C@H]1C2=CC=CC=C2C[C@H]1O CNP0310870.1 [0,1,0,1,0,0|1,0,0]=3 227 B13R2.3076 CC1=C(C1(C)C2=CC=CC=C2)C CNP0518604.0 [0,1,0,1,0,0|2,0,0]=4 228 B13R2.7350 CC[C@@]1(C2=CC=CC=C2[C@@H]1C)O CNP0361439.1 [0,1,0,1,0,0|2,0,0]=4 229 B13R2.7350 CC[C@@]1(C2=CC=CC=C2[C@H]1C)O CNP0361439.2 [0,1,0,1,0,0|2,0,0]=4 230 B13R2.7350 CC[C@]1(C2=CC=CC=C2[C@@H]1C)O CNP0361439.3 [0,1,0,1,0,0|2,0,0]=4 231 B13R2.7350 CC[C@]1(C2=CC=CC=C2[C@H]1C)O CNP0361439.4 [0,1,0,1,0,0|2,0,0]=4 232 B13R3.1962 C1=C[C@@H]2O[C@@H]1C3=CC=CC=C23 CNP0042340.2 [0,0,0,2,0,0|1,0,1]=4 233 B13R3.1962 C1=C[C@H]2O[C@@H]1C3=CC=CC=C23 CNP0042340.1 [0,0,0,2,0,0|1,0,1]=4 234 B11R1.40 CC(CC1=CC=CC=C1)NN CNP0490406.0 [1,0,0,0,0,1|2,0,0]=4 235 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 CNP0515672.1 [1,0,0,0,0,1|2,0,0]=4 236 B11R1.40 CN[C@@H](C)CC1=CC=CC=C1 CNP0351439.1 [1,0,0,0,0,1|1,0,0]=3 237 B11R1.40 CN[C@H](C)CC1=CC=CC=C1 CNP0351439.2 [1,0,0,0,0,1|1,0,0]=3 238 B11R1.40 COC(=O)CC1=CC=CC=C1 CNP0328249.0 [1,0,0,0,0,1|0,0,2]=4 239 B11R1.40 COC(=S)NC1=CC=CC=C1 CNP0050030.0 [1,0,0,0,0,1|0,1,1]=4 240 B11R1.40 C[C@@H](C=O)CC1=CC=CC=C1 CNP0101541.1 [1,0,0,0,0,1|2,0,0]=4 241 B11R1.40 N#C[C@H](O)CC1=CC=CC=C1 CNP0304006.1 [1,0,0,0,0,1|2,0,0]=4 242 B11R1.40 OC[C@@H](O)CC1=CC=CC=C1 CNP0380924.2 [1,0,0,0,0,1|2,0,0]=4 243 B11R1.40 OC[C@H](O)CC1=CC=CC=C1 CNP0380924.1 [1,0,0,0,0,1|2,0,0]=4 244 B11R1.852 COC(=O)C1=CC=CC=CO1 CNP0163197.0 [1,0,0,0,0,1|0,0,2]=4 245 B13R1.417 COC(C=CC1=CC=CC=C1)OC CNP0250710.0 [0,0,0,0,0,2|0,0,0]=2 246 B13R1.417 COC(CCC1=CC=CC=C1)OC CNP0293429.0 [0,0,0,0,0,2|0,0,0]=2