0 B9R0.24 CCC(=O)CCC(=O)CC AMY42063 [0,0,0,0,0,0|2,0,0]=2 1 B9R0.24 CCC(=O)CCC(=O)OC AMY30255 [0,0,0,0,0,0|1,0,0]=1 2 B9R0.24 COC(=O)C#CC(=O)OC AM87182 [0,0,0,0,0,0|0,0,2]=2 3 B9R0.24 COC(=O)\C=C/C(=O)OC AMY4058 [0,0,0,0,0,0|0,0,2]=2 4 B9R0.24 NNC(=O)CCC(=O)NN AMY3980 [0,0,0,0,0,0|4,0,0]=4 5 B8R0.6 CCNCCC(=O)OC AMY20543 [1,0,0,0,0,0|2,0,0]=3 6 B8R0.6 COC(=O)CCCCBr AM20120637 [1,0,0,0,0,0|2,0,1]=4 7 B8R0.6 COC(=O)CCN=C=O AMY6679 [1,0,0,0,0,0|3,0,0]=4 8 B8R0.9 CC(=O)OCC(=O)CCl AMY14363 [1,0,0,0,0,0|3,0,0]=4 9 B8R0.9 CCC(=O)CCC(=O)O AMY30226 [1,0,0,0,0,0|1,0,0]=2 10 B8R0.9 CCC(=O)COC(C)=O AM20080565 [1,0,0,0,0,0|2,0,0]=3 11 B8R0.9 COC(=O)CCC(=O)O AM20100028 [1,0,0,0,0,0|0,0,0]=1 12 B8R0.9 COC(=O)CCC(=O)[O-] AMY4106 [1,0,0,0,0,0|0,0,1]=2 13 B8R0.9 COC(=O)CCN(C)C AM807052 [1,0,0,0,0,0|2,0,0]=3 14 B8R0.9 NCC(=O)CCC(=O)O AM20100341 [1,0,0,0,0,0|2,0,0]=3 15 B8R0.9 NCC(=O)NCC(=O)O AMY25302 [1,0,0,0,0,0|3,0,0]=4 16 B10R0.45 COC(=O)CCC(OC)OC AMY41993 [0,1,0,0,0,0|0,0,2]=3 17 B10R0.46 COC(=O)C[C@H](N)C(=O)OC AM81593 [0,1,0,0,0,0|0,0,0]=1 18 B10R0.46 COC(=O)C[C@H](N)C(=O)OC AM81642 [0,1,0,0,0,0|0,0,0]=1 19 B10R0.46 COC(=O)C[C@H](N)C(=O)OC AM83145 [0,1,0,0,0,0|0,0,0]=1 20 B10R0.46 COC(=O)C[C@H](O)C(=O)OC AM81421 [0,1,0,0,0,0|0,0,0]=1 21 B10R0.82 COC(=O)CNC(=O)[C@H](C)N AMY13624 [0,1,0,0,0,0|2,0,0]=3 22 B10R1.14 COC(=O)C1CCC(N)C1 AMY19590 [0,0,0,1,0,0|2,0,1]=4 23 B10R1.14 COC(=O)[C@@H]1CC(=O)CO1 AMY23670 [0,0,0,1,0,0|2,0,0]=3 24 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 AMY35284 [0,0,0,1,0,0|1,0,0]=2 25 B10R1.14 COC(=O)[C@@H]1CCC(=O)N1 AM20100208 [0,0,0,1,0,0|2,0,0]=3 26 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 AMY14676 [0,0,0,1,0,0|2,0,1]=4 27 B10R1.14 COC(=O)[C@@H]1CNC(=O)C1 AM803764 [0,0,0,1,0,0|1,0,0]=2 28 B10R1.14 COC(=O)[C@@H]1CSC(=O)N1 AMY14974 [0,0,0,1,0,0|1,1,0]=3 29 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 AMY26568 [0,0,0,1,0,0|1,0,0]=2 30 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 AMY35290 [0,0,0,1,0,0|1,0,0]=2 31 B10R1.14 COC(=O)[C@H]1CCC(=O)N1 AMY38669 [0,0,0,1,0,0|2,0,0]=3 32 B10R1.14 COC(=O)[C@H]1CCN(C)C1 AMY2411 [0,0,0,1,0,0|3,0,0]=4 33 B8R0.19 CCC(=O)CC(=O)CC AMY8840 [0,0,0,0,1,0|2,0,0]=3 34 B8R0.19 CCC(=O)CC(=O)OC AMY21932 [0,0,0,0,1,0|1,0,0]=2 35 B8R0.19 CC[C@H](O)CC(=O)OC AM85819 [0,0,0,0,1,0|1,0,2]=4 36 B8R0.19 COC(=N)CC(=O)OC AMY31003 [0,0,0,0,1,0|1,0,0]=2 37 B8R0.19 COC(=O)CC(=O)OC AMY10014 [0,0,0,0,1,0|0,0,0]=1 38 B10R0.59 COC(=O)CNCC(=O)OC AMY10184 [0,0,0,0,0,1|0,0,0]=1 39 B10R0.59 COC(=O)COCC(=O)OC AMY41876 [0,0,0,0,0,1|0,0,0]=1 40 B7R0.3 CNCCC(=O)OC AMY4326 [2,0,0,0,0,0|1,0,0]=3 41 B7R0.3 COC(=O)CCC=O AM20080287 [2,0,0,0,0,0|0,0,0]=2 42 B7R0.3 COC(=O)CCCN AM803145 [2,0,0,0,0,0|1,0,1]=4 43 B7R0.3 COC(=O)CCCS AMY40461 [2,0,0,0,0,0|0,1,1]=4 44 B7R0.3 CO\C=C\C(=O)OC AMY18381 [2,0,0,0,0,0|0,0,1]=3 45 B7R0.3 [C-]#[N+]CCC(=O)OC AMY21714 [2,0,0,0,0,0|1,0,1]=4 46 B7R0.4 CNCCCC(=O)O AMY5046 [2,0,0,0,0,0|1,0,1]=4 47 B7R0.6 CC(=O)CCC(=O)O AM20080171 [2,0,0,0,0,0|0,0,0]=2 48 B7R0.6 CC(=O)CCC(C)=O AMY25528 [2,0,0,0,0,0|0,0,0]=2 49 B7R0.6 CC(=O)CNC(C)=O AMY32031 [2,0,0,0,0,0|1,0,0]=3 50 B7R0.6 CC(=O)NCC(=O)O AM81782 [2,0,0,0,0,0|1,0,0]=3 51 B7R0.6 CC(=O)OCC(=O)Cl AMY39424 [2,0,0,0,0,0|2,0,0]=4 52 B7R0.6 CC(=O)OCC(=O)O AMY3826 [2,0,0,0,0,0|1,0,0]=3 53 B7R0.6 CN(C)CCC(=O)O AM86616 [2,0,0,0,0,0|2,0,0]=4 54 B7R0.6 O=C(Cl)CCC(=O)Cl AMY4013 [2,0,0,0,0,0|2,0,0]=4 55 B7R0.6 O=C(O)\C=C\C(=O)O AMY30339 [2,0,0,0,0,0|0,0,2]=4 56 B9R0.8 CCCC[C@H](Br)C(=O)OC AMY21797 [1,1,0,0,0,0|1,0,1]=4 57 B9R0.8 CCCC[C@H](N)C(=O)OC AM82593 [1,1,0,0,0,0|1,0,1]=4 58 B9R0.34 COCC(=O)CC(=O)OC AMY38262 [1,1,0,0,0,0|0,0,2]=4 59 B9R0.46 COC(=O)CCCCCBr AMY17985 [1,1,0,0,0,0|1,0,1]=4 60 B9R0.46 COC(=O)CCCCCN AM20090125 [1,1,0,0,0,0|1,0,1]=4 61 B9R0.7 C[C@H](Cl)C(=O)NCC(=O)O AMY10265 [1,1,0,0,0,0|2,0,0]=4 62 B9R0.7 C[C@H](S)C(=O)NCC(=O)O AMY39003 [1,1,0,0,0,0|2,0,0]=4 63 B9R0.7 O=C(O)CCC(=O)C(=O)O AM20090486 [1,1,0,0,0,0|2,0,0]=4 64 B9R0.21 COC(=O)CCS(N)(=O)=O AMY32109 [1,1,0,0,0,0|1,0,1]=4 65 B9R0.23 C=C(NC(C)=O)C(=O)OC AM803766 [1,1,0,0,0,0|1,0,1]=4 66 B9R0.23 COC(=O)C(=O)CC(C)=O AMY3225 [1,1,0,0,0,0|0,0,1]=3 67 B9R0.23 COC(=O)[C@@H](N)CC(=O)O AMY31364 [1,1,0,0,0,0|0,0,0]=2 68 B9R0.23 COC(=O)[C@@H](N)CC(C)C AM20100563 [1,1,0,0,0,0|1,0,1]=4 69 B9R0.23 COC(=O)[C@@H](N)CC(C)C AM20100730 [1,1,0,0,0,0|1,0,1]=4 70 B9R0.23 COC(=O)[C@@H](N)CC(C)C AM81877 [1,1,0,0,0,0|1,0,1]=4 71 B9R0.23 COC(=O)[C@@H](N)CC(N)=O AM81563 [1,1,0,0,0,0|1,0,0]=3 72 B9R0.42 COC(=O)CC(=O)C(=O)O AM806672 [1,1,0,0,0,0|0,0,1]=3 73 B9R0.42 COC(=O)C[C@H](N)C(=O)O AM20090012 [1,1,0,0,0,0|0,0,0]=2 74 B9R0.42 COC(=O)C[C@H](N)C(=O)O AM20090073 [1,1,0,0,0,0|0,0,0]=2 75 B9R0.48 CCOC(=O)CC[N+](=O)[O-] AM20090569 [1,1,0,0,0,0|1,0,1]=4 76 B9R0.48 CCOC(=O)CNC(C)=O AM20090112 [1,1,0,0,0,0|1,0,0]=3 77 B9R0.26 COC(=O)CC(OC)OC AMY7037 [0,1,0,0,1,0|0,0,2]=4 78 B9R0.27 CCC(=O)[C@H](F)C(=O)OC AM62556 [0,1,0,0,1,0|1,0,0]=3 79 B9R0.27 COC(=O)C(Br)C(=O)OC AM81029 [0,1,0,0,1,0|0,0,0]=2 80 B9R0.27 COC(=O)C(F)C(=O)OC AMY6801 [0,1,0,0,1,0|0,0,0]=2 81 B9R0.27 COC(=O)C(N)C(=O)OC AMY15717 [0,1,0,0,1,0|0,0,0]=2 82 B11R0.110 COC(=O)CC(=O)CC(=O)OC AM20090069 [0,1,0,0,0,1|0,0,0]=2 83 B11R0.110 COC(=O)CC(C)CC(=O)OC AMY3884 [0,1,0,0,0,1|0,0,0]=2 84 B11R0.110 COC(=O)\C=C(/C)CC(=O)OC AMY40700 [0,1,0,0,0,1|0,0,1]=3 85 B11R0.120 COC(=O)CCC(=O)C(=O)OC AMY20457 [0,1,0,0,0,1|0,0,0]=2 86 B11R0.120 COC(=O)CC[C@H](C)C(=O)OC AMY3829 [0,1,0,0,0,1|0,0,0]=2 87 B11R0.120 COC(=O)CC[C@H](N)C(=O)OC AM81752 [0,1,0,0,0,1|0,0,0]=2 88 B11R0.120 COC(=O)CC[C@H](N)C(=O)OC AM83094 [0,1,0,0,0,1|0,0,0]=2 89 B11R0.66 COC(=O)[C@@H](O)[C@@H](O)C(=O)OC AM81413 [0,2,0,0,0,0|0,0,0]=2 90 B11R0.66 COC(=O)[C@@H](O)[C@H](O)C(=O)OC AM81412 [0,2,0,0,0,0|0,0,0]=2 91 B11R0.66 COC(=O)\C(F)=C(/F)C(=O)OC AMY14687 [0,2,0,0,0,0|0,0,2]=4 92 B11R0.66 COC(=O)\C(F)=C(\F)C(=O)OC AMY14688 [0,2,0,0,0,0|0,0,2]=4 93 B11R0.66 COC(=O)\C(O)=C(/O)C(=O)OC AMY18044 [0,2,0,0,0,0|0,0,2]=4 94 B11R0.62 CCOC(=O)\C=C/C(=O)OCC AMY3405 [0,2,0,0,0,0|0,0,2]=4 95 B11R0.62 CCOC(=O)\C=C\C(=O)OCC AMY18090 [0,2,0,0,0,0|0,0,2]=4 96 B9R1.1 COC1CCC(=O)CC1 AMY3589 [1,0,0,1,0,0|1,0,1]=4 97 B9R1.7 CCC[C@H]1COC(=O)C1 AMY16477 [1,0,0,1,0,0|1,0,1]=4 98 B9R1.11 COC(=O)C1CCCC1 AM803935 [1,0,0,1,0,0|1,0,1]=4 99 B9R1.11 COC(=O)[C@@H]1CCNC1 AMY23600 [1,0,0,1,0,0|1,0,1]=4 100 B9R1.11 COC(=O)[C@H]1CCNC1 AM20120399 [1,0,0,1,0,0|1,0,1]=4 101 B9R1.11 COC(=O)[C@H]1CCNC1 AM20120502 [1,0,0,1,0,0|1,0,1]=4 102 B9R1.11 COC(=O)[C@H]1CCNC1 AMY14571 [1,0,0,1,0,0|1,0,1]=4 103 B9R1.11 COC(=O)[C@H]1CCOC1 AMY202100097 [1,0,0,1,0,0|0,0,1]=3 104 B9R1.79 COC(=O)CC1CNC1 AMY34161 [1,0,0,1,0,0|1,0,1]=4 105 B9R1.81 COC(=O)C1CNC1C AMY35763 [1,0,0,1,0,0|2,0,0]=4 106 B9R1.35 CC(=O)N1CCC(=O)C1 AM100682 [1,0,0,1,0,0|2,0,0]=4 107 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 AMY34326 [1,0,0,1,0,0|1,0,0]=3 108 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 AM20080373 [1,0,0,1,0,0|2,0,0]=4 109 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 AM20100078 [1,0,0,1,0,0|2,0,0]=4 110 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 AM83732 [1,0,0,1,0,0|2,0,0]=4 111 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 AM20100317 [1,0,0,1,0,0|2,0,0]=4 112 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 AM84751 [1,0,0,1,0,0|2,0,0]=4 113 B9R1.35 O=C1CC[C@@H](C(=O)O)S1 AMY33941 [1,0,0,1,0,0|2,0,0]=4 114 B9R1.35 O=C1CC[C@H](C(=O)O)C1 AM20120395 [1,0,0,1,0,0|1,0,0]=3 115 B9R1.35 O=C1CC[C@H](C(=O)O)C1 AMY34343 [1,0,0,1,0,0|1,0,0]=3 116 B9R1.35 O=C1CN[C@H](C(=O)O)C1 AMY34990 [1,0,0,1,0,0|2,0,0]=4 117 B9R1.35 O=C1CN[C@H](C(=O)O)C1 AMY36594 [1,0,0,1,0,0|2,0,0]=4 118 B9R1.35 O=C1C[C@@H](C(=O)O)CN1 AMY35785 [1,0,0,1,0,0|1,0,0]=3 119 B9R1.82 C=C1CC(C(=O)OC)C1 AM85374 [1,0,0,1,0,0|1,0,0]=3 120 B9R1.82 COC(=O)C1CC(=O)C1 AM20070620 [1,0,0,1,0,0|0,0,0]=2 121 B9R1.82 COC(=O)C1CC(Br)C1 AM85789 [1,0,0,1,0,0|1,0,1]=4 122 B9R1.82 COC(=O)C1CC(Cl)C1 AMY34166 [1,0,0,1,0,0|1,0,1]=4 123 B9R1.82 COC(=O)C1CC(F)C1 AM85364 [1,0,0,1,0,0|1,0,1]=4 124 B9R1.82 COC(=O)C1CC(N)C1 AM85499 [1,0,0,1,0,0|1,0,1]=4 125 B9R1.82 COC(=O)C1CC(N)C1 AM85562 [1,0,0,1,0,0|1,0,1]=4 126 B9R1.82 COC(=O)C1CC(O)C1 AM20070616 [1,0,0,1,0,0|0,0,2]=4 127 B9R1.82 COC(=O)[C@H]1C[C@@H](N)C1 AMY14943 [1,0,0,1,0,0|1,0,1]=4 128 B9R1.82 COC(=O)[C@H]1C[C@@H](O)C1 AM10832 [1,0,0,1,0,0|0,0,2]=4 129 B9R1.82 COC(=O)[C@H]1C[C@H](Br)C1 AMY34213 [1,0,0,1,0,0|1,0,1]=4 130 B9R1.82 COC(=O)[C@H]1C[C@H](N)C1 AMY14941 [1,0,0,1,0,0|1,0,1]=4 131 B9R1.95 COC1CC(C(=O)O)C1 AM85782 [1,0,0,1,0,0|1,0,1]=4 132 B9R1.48 O=C1CCCCC(=O)C1 AM85496 [0,0,0,1,1,0|2,0,0]=4 133 B11R1.22 COC(=O)C1CCC(=O)CC1 AM20070503 [0,0,0,1,0,1|1,0,0]=3 134 B11R1.22 COC(=O)[C@@H]1CC=C(Cl)CC1 AMY15383 [0,0,0,1,0,1|2,0,0]=4 135 B11R1.851 COC(=O)[C@@H]1C[C@H]1C(=O)OC AMY3257 [0,0,0,1,0,1|0,0,0]=2 136 B11R1.851 COC(=O)[C@H]1C[C@H]1C(=O)OC AMY3265 [0,0,0,1,0,1|0,0,0]=2 137 B11R1.865 COC(=O)[C@@H]1CCC(=O)N1C AMY13629 [0,0,0,1,0,1|1,0,0]=3 138 B11R1.865 COC(=O)[C@H]1CCC(=O)N1C AMY13598 [0,0,0,1,0,1|1,0,0]=3 139 B11R1.23 COC(=O)[C@@H]1CCCC(=O)N1 AM802931 [0,1,0,1,0,0|2,0,0]=4 140 B11R1.23 COC(=O)[C@@H]1CNCC(=O)N1 AMY7518 [0,1,0,1,0,0|2,0,0]=4 141 B11R1.23 COC(=O)[C@H]1CCCC(=O)C1 AMY19012 [0,1,0,1,0,0|1,0,0]=3 142 B11R1.226 CNC(=O)[C@H]1CC(=O)N(C)C1 AM804520 [0,1,0,1,0,0|2,0,0]=4 143 B11R1.226 COC(=O)[C@H]1CC(=O)N(C)C1 AM803888 [0,1,0,1,0,0|1,0,0]=3 144 B11R1.228 COC(=O)CN1CCCC1=O AMY14525 [0,1,0,1,0,0|2,0,0]=4 145 B11R1.15 CCOC(=O)N1CCC(=O)C1 AM20080372 [0,1,0,1,0,0|2,0,0]=4 146 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 AM20100678 [0,1,0,1,0,0|2,0,0]=4 147 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 AM806355 [0,1,0,1,0,0|2,0,0]=4 148 B11R1.15 CCOC(=O)[C@@H]1CNC(=O)C1 AMY21376 [0,1,0,1,0,0|1,0,0]=3 149 B11R1.15 CCOC(=O)[C@H]1CCC(=O)C1 AM20120572 [0,1,0,1,0,0|1,0,0]=3 150 B11R1.15 CCOC(=O)[C@H]1CCC(=O)N1 AMY25307 [0,1,0,1,0,0|2,0,0]=4 151 B11R1.121 COC=C1CC(C(=O)OC)C1 AM85366 [0,1,0,1,0,0|1,0,0]=3 152 B11R2.60 O=C1CCC2C(=O)CCC12 AMY205 [0,0,0,2,0,0|2,0,0]=4 153 B7R0.2 CCC(=O)CC(=O)O AM85448 [1,0,0,0,1,0|1,0,0]=3 154 B7R0.2 CCC(=O)CC(=O)[O-] AM88443 [1,0,0,0,1,0|1,0,1]=4 155 B7R0.2 CCC(=O)CC(C)=O AMY2701 [1,0,0,0,1,0|1,0,0]=3 156 B7R0.2 COC(=O)CC(=O)Cl AM90205 [1,0,0,0,1,0|1,0,0]=3 157 B7R0.2 COC(=O)CC(=O)[O-] AMY3708 [1,0,0,0,1,0|0,0,1]=3 158 B7R0.2 COC(=O)CC(=O)[O-] AMY3965 [1,0,0,0,1,0|0,0,1]=3 159 B7R0.2 COC(=O)C[C@H](C)O AM20090811 [1,0,0,0,1,0|0,0,2]=4 160 B7R0.2 COC(=O)C[C@H](C)O AM20100049 [1,0,0,0,1,0|0,0,2]=4 161 B7R0.2 COC(=O)C[C@H](C)O AMY3321 [1,0,0,0,1,0|0,0,2]=4 162 B7R0.2 COC(=O)C[N+](=O)[O-] AM86803 [1,0,0,0,1,0|1,0,1]=4 163 B7R0.2 COC(=O)\C=C(\C)F AMY36917 [1,0,0,0,1,0|1,0,1]=4 164 B7R0.2 COC(=O)\C=C(\C)N AM20080319 [1,0,0,0,1,0|1,0,1]=4 165 B7R0.10 COC(=O)C(=O)CBr AMY30900 [0,0,0,0,2,0|2,0,0]=4 166 B7R0.10 COC(=O)C(=O)OC AMY37133 [0,0,0,0,2,0|0,0,0]=2 167 B7R0.10 COC(=O)[C@H](C)OC AMY37763 [0,0,0,0,2,0|1,0,1]=4