0 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O Amb2708782 [0,0,0,0,0,0|0,0,4]=4 1 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O Amb34195662 [0,0,0,0,0,0|0,0,4]=4 2 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)O Amb22432561 [0,0,0,0,0,0|0,0,2]=2 3 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)O Amb6600107 [0,0,0,0,0,0|0,0,2]=2 4 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)[O-] Amb19960036 [0,0,0,0,0,0|0,0,3]=3 5 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)[O-] Amb8514496 [0,0,0,0,0,0|0,0,3]=3 6 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(N)=O Amb17618835 [0,0,0,0,0,0|1,0,2]=3 7 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(=O)Cl Amb20001478 [0,0,0,0,0,0|1,0,2]=3 8 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(=O)O Amb33987863 [0,0,0,0,0,0|0,0,2]=2 9 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(=O)O Amb7809233 [0,0,0,0,0,0|0,0,2]=2 10 B19R0.149 CCCCCC\C=C\CCCCCCCCCC(=O)O Amb6297192 [0,0,0,0,0,0|0,0,4]=4 11 B19R0.149 CCCCC\C=C/C\C=C/CCCCCCCC(=O)O Amb6307468 [0,0,0,0,0,0|0,0,0]=0 12 B19R0.149 CCCCC\C=C/C\C=C/C\C=C/CCCCC(=O)O Amb6298380 [0,0,0,0,0,0|0,0,2]=2 13 B19R0.149 CCCCC\C=C\C\C=C\CCCCCCCC(=O)O Amb33961505 [0,0,0,0,0,0|0,0,0]=0 14 B19R0.149 CCCCC\C=C\C\C=C\CCCCCCCC(=O)[O-] Amb33982973 [0,0,0,0,0,0|0,0,1]=1 15 B19R0.149 CCCC\C=C\CC\C=C/CCCCCCOC(C)=O Amb21965170 [0,0,0,0,0,0|2,0,2]=4 16 B19R0.149 CC\C=C\C\C=C\C\C=C\CCCCCCCC(=O)O Amb533196 [0,0,0,0,0,0|0,0,2]=2 17 B18R0.176 CCCCCCCCCCCCCCCCC(=O)O Amb8515709 [1,0,0,0,0,0|0,0,3]=4 18 B18R0.221 CCCCCCCC\C=C/CCCCCCCCO Amb8513278 [1,0,0,0,0,0|0,0,3]=4 19 B18R0.221 CCCCCCCC\C=C\CCCCCCCCO Amb2778975 [1,0,0,0,0,0|0,0,3]=4 20 B18R0.221 CCCCC\C=C/C\C=C/CCCCCCCCBr Amb33719458 [1,0,0,0,0,0|1,0,1]=3 21 B18R0.221 CCCCC\C=C/C\C=C/CCCCCCCCO Amb20240595 [1,0,0,0,0,0|0,0,1]=2 22 B18R0.221 CCCCC\C=C\C\C=C\CCCCCCCCBr Amb22346840 [1,0,0,0,0,0|1,0,1]=3 23 B18R0.221 CCCCC\C=C\C\C=C\CCCCCCCCO Amb33987739 [1,0,0,0,0,0|0,0,1]=2 24 B20R0.68 CCCCCCCCC(=O)CCCCCCCCC(=O)O Amb5718338 [0,1,0,0,0,0|0,0,3]=4 25 B20R0.90 CCCCCC[C@@H](O)C\C=C/CCCCCCCC(=O)O Amb22348318 [0,1,0,0,0,0|0,0,2]=3 26 B20R0.90 CCCCCC[C@@H](O)C\C=C\CCCCCCCC(=O)O Amb34915173 [0,1,0,0,0,0|0,0,2]=3 27 B20R0.3034 CCCCCCCC\C=C/CCCCCCCC(=O)OC Amb8516707 [0,1,0,0,0,0|0,0,2]=3 28 B20R0.3034 CCCCCCCC\C=C\CCCCCCCC(=O)OC Amb4379349 [0,1,0,0,0,0|0,0,2]=3 29 B20R0.3034 CCCCC\C=C/C\C=C/CCCCCCCC(=O)OC Amb6307471 [0,1,0,0,0,0|0,0,0]=1 30 B20R0.3034 CCCCC\C=C\C\C=C\CCCCCCCC(=O)OC Amb31288713 [0,1,0,0,0,0|0,0,0]=1 31 B17R0.43 CCCCCCCCCCCCCCCC(=O)O Amb2708781 [2,0,0,0,0,0|0,0,2]=4 32 B17R0.43 CCCCCCCCCCCCCCCC(=O)O Amb32414662 [2,0,0,0,0,0|0,0,2]=4 33 B17R0.43 CCCCCCCCCCCCCCCC(=O)O Amb34915028 [2,0,0,0,0,0|0,0,2]=4 34 B17R0.43 CCCCCCCC\C=C\CCCCCC(=O)O Amb31031047 [2,0,0,0,0,0|0,0,2]=4 35 B17R0.43 CCCCCC\C=C\CCCCCCCC(=O)O Amb33723687 [2,0,0,0,0,0|0,0,0]=2 36 B19R0.148 CCCCCC\C=C/CCCCCCCCC(=O)OC Amb22352444 [1,1,0,0,0,0|0,0,2]=4 37 B21R0.14440 CCC(O)C(O)C\C=C/C\C=C/CCCCCCCC(=O)O Amb23440471 [0,2,0,0,0,0|0,0,0]=2 38 B21R0.2907 C=COC(=O)CCCCCCC\C=C\CCCCCCCC Amb17672569 [0,2,0,0,0,0|0,0,2]=4 39 B21R0.2907 CCCCCCCC\C=C/CCCCCCCC(=O)OCC Amb8515780 [0,2,0,0,0,0|0,0,2]=4 40 B21R0.2907 CCCCC\C=C/C\C=C/CCCCCCCC(=O)OCC Amb8628520 [0,2,0,0,0,0|0,0,0]=2 41 B21R0.2907 CCCCC\C=C/C\C=C/C\C=C/CCCCC(=O)OCC Amb22362863 [0,2,0,0,0,0|0,0,2]=4 42 B21R0.2907 CCCCC\C=C\C\C=C\CCCCCCCC(=O)OCC Amb4379311 [0,2,0,0,0,0|0,0,0]=2 43 B21R0.2907 CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)OCC Amb8516991 [0,2,0,0,0,0|0,0,2]=4 44 B21R0.81 CCCCCCCC\C=C/CCCCCCCCCC(=O)O Amb22337523 [0,2,0,0,0,0|0,0,2]=4 45 B21R0.81 CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)O Amb2718791 [0,2,0,0,0,0|0,0,2]=4 46 B21R0.81 CCCCC\C=C\C\C=C\CCCCCCCCCC(=O)O Amb21928664 [0,2,0,0,0,0|0,0,0]=2 47 B21R0.81 CCCCC\C=C\C\C=C\C\C=C\CCCCCCC(=O)O Amb30594182 [0,2,0,0,0,0|0,0,0]=2 48 B21R0.81 CCCCC\C=C\C\C=C\C\C=C\C\C=C\CCCC(=O)O Amb29566293 [0,2,0,0,0,0|0,0,2]=4