0 B11R0.43 CCOC(=O)C(=O)CC(=O)CC LX3276 [0,0,0,0,0,0|0,0,0]=0 1 B10R0.19 CCCCC(Br)C(=O)OCC LQ1177 [1,0,0,0,0,0|1,0,2]=4 2 B10R0.32 CCOC(=O)C(=O)CC(C)=O LQ1173 [1,0,0,0,0,0|0,0,0]=1 3 B10R0.46 C=C(CC(=O)OC)C(=O)OC LQ1205 [1,0,0,0,0,0|2,0,0]=3 4 B10R0.46 COC(=O)CC(N)C(=O)OC JZ1394 [1,0,0,0,0,0|2,0,1]=4 5 B10R0.46 COC(=O)C[C@@H](Br)C(=O)OC RT0661 [1,0,0,0,0,0|2,0,1]=4 6 B10R0.108 C\C=C(C)\C=C\C(=O)OCC RT18867 [1,0,0,0,0,0|1,0,2]=4 7 B12R0.69 CCCC(=O)CC(=O)C(=O)OCC RT1242 [0,1,0,0,0,0|0,0,0]=1 8 B12R0.69 CCOC(=O)\C=C(\Cl)C(=O)OCC RT0088 [0,1,0,0,0,0|1,0,1]=3 9 B10R0.35 CCOC(=O)C(F)C(=O)CC XJ1321 [0,0,0,0,1,0|1,0,1]=3 10 B9R0.34 CCOC(=O)CC(=O)CBr JZ3662 [2,0,0,0,0,0|1,0,0]=3 11 B9R0.34 CCOC(=O)CC(=O)CC XJ2812 [2,0,0,0,0,0|0,0,0]=2 12 B9R0.34 CCOC(=O)CC(=O)CCl JZ0314 [2,0,0,0,0,0|1,0,0]=3 13 B9R0.34 CCOC(=O)CC(=O)NC LX2309 [2,0,0,0,0,0|1,0,0]=3 14 B9R0.34 CCOC(=O)NC(=S)CC RT0256 [2,0,0,0,0,0|1,1,0]=4 15 B9R0.34 COCC(=O)CC(=O)OC LT3021 [2,0,0,0,0,0|1,0,1]=4 16 B9R0.5 CCO\C=C\C(=O)OCC HL0560 [2,0,0,0,0,0|1,0,1]=4 17 B9R0.5 CCO\C=C\C(=O)OCC LQ2963 [2,0,0,0,0,0|1,0,1]=4 18 B9R0.35 CCNC(=O)C(=O)NCC LQ1175 [2,0,0,0,0,0|2,0,0]=4 19 B9R0.35 CCOC(=N)C(=O)OCC YH06755 [2,0,0,0,0,0|2,0,0]=4 20 B9R0.35 CCOC(=N)C(=O)OCC YH19941 [2,0,0,0,0,0|2,0,0]=4 21 B9R0.35 CCOC(=O)C(=O)OCC LQ0292 [2,0,0,0,0,0|1,0,0]=3 22 B9R0.48 CCOC(=O)CNC(C)=O LQ2002 [2,0,0,0,0,0|1,0,1]=4 23 B9R0.48 CCOC(=O)\C=C/C(=O)O RT18747 [2,0,0,0,0,0|1,0,1]=4 24 B9R0.48 CCOC(=O)\C=C\C(=O)[O-] RT0568 [2,0,0,0,0,0|1,0,1]=4 25 B9R0.48 CCOC(=O)\C=C\C(=O)[O-] RT0768 [2,0,0,0,0,0|1,0,1]=4 26 B9R0.48 CCOC(=O)\C=C\C(=O)[O-] RT0833 [2,0,0,0,0,0|1,0,1]=4 27 B9R0.24 CCC(=O)CCC(=O)CC RT0042 [2,0,0,0,0,0|0,0,1]=3 28 B9R0.24 COC(=O)CCC(=O)OC HL1321 [2,0,0,0,0,0|1,0,1]=4 29 B11R0.177 CCOC(=O)C(=O)C(=O)OCC XJ1071 [1,1,0,0,0,0|1,0,1]=4 30 B11R0.62 CCOC(=O)C#CC(=O)OCC XJ1329 [1,1,0,0,0,0|0,0,2]=4 31 B11R0.62 CCOC(=O)CCC(=O)OCC XJ0500 [1,1,0,0,0,0|0,0,1]=3 32 B11R0.62 CCOC(=O)\C=C/C(=O)OCC YH34085 [1,1,0,0,0,0|0,0,1]=3 33 B11R0.62 CCOC(=O)\N=N\C(=O)OCC JZ1836 [1,1,0,0,0,0|2,0,0]=4 34 B11R0.53 CCOC(=O)\C(C#N)=C(/C)CC RT16402 [0,1,0,0,1,0|2,0,0]=4 35 B13R0.89 CCOC(=O)CC(=O)CC(=O)OCC XJ0320 [0,1,0,0,0,1|0,0,0]=2 36 B13R0.18 CCOC(=O)CC[C@H](O)C(=O)OCC RT0625 [0,1,0,0,0,1|0,0,2]=4 37 B13R0.18 [C@H](N)(CCC(=O)OCC)C(=O)OCC XJ1580 [0,1,0,0,0,1|1,0,1]=4 38 B13R0.674 CCOC(=O)C(Cl)C(Cl)C(=O)OCC LL1037 [0,2,0,0,0,0|1,0,1]=4 39 B11R1.16 CCOC(=O)C1=CCC=CC1 RT16430 [1,0,0,1,0,0|1,0,1]=4 40 B11R1.199 CCOC(=O)C1=C(N)CCC1 LT0730 [0,0,0,1,1,0|2,0,0]=4 41 B13R1.1463 CCOC(=O)N1CCCC(=O)CC1 RT17581 [0,0,0,1,0,1|2,0,0]=4 42 B9R0.6 CCOC(=O)C(=O)C(C)Br RT18792 [1,0,0,0,1,0|1,0,1]=4 43 B9R0.6 CCOC(=O)C(=O)N(C)C LQ3958 [1,0,0,0,1,0|2,0,0]=4 44 B9R0.6 CCOC(=O)C(C)C(C)=O XJ1073 [1,0,0,0,1,0|1,0,1]=4 45 B9R0.6 CCOC(=O)C(Cl)C(C)=O LT1703 [1,0,0,0,1,0|1,0,1]=4 46 B9R0.6 CCOC(=O)\C(C)=C(\C)N RT17576 [1,0,0,0,1,0|2,0,0]=4 47 B9R0.27 CCC(=O)C(F)C(=O)OC LT5780 [1,0,0,0,1,0|1,0,1]=4 48 B11R0.1 CCOC(=O)CC(=O)CC(C)O CJ2848 [1,0,0,0,0,1|0,0,2]=4 49 B13R0.1521 CCOC(=O)CC(=O)CCC(=O)OC LX2157 [0,0,0,0,0,2|1,0,0]=3