0 B19R0.149 C#CCCCCCCCCCCCCCCCC(=O)O 90270 [0,0,0,0,0,0|0,0,4]=4 1 B19R0.149 C#CCCCCCC\C=C/CCCCCCCC(=O)O 9002078 [0,0,0,0,0,0|0,0,2]=2 2 B19R0.149 C#CCCC\C=C/C\C=C/CCCCCCCC(=O)O 10541 [0,0,0,0,0,0|0,0,4]=4 3 B19R0.149 CCCCCC#CCC#CCCCCCCCC(=O)O 90400 [0,0,0,0,0,0|0,0,4]=4 4 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)N 21087 [0,0,0,0,0,0|1,0,2]=3 5 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O 10011298 [0,0,0,0,0,0|0,0,2]=2 6 B19R0.149 CCCCCCCCCCC\C=C/CCCCC(=O)O 20024 [0,0,0,0,0,0|0,0,4]=4 7 B19R0.149 CCCCCCCCSCCCCCCCCC(=O)O 10007417 [0,0,0,0,0,0|1,0,1]=2 8 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)N 90375 [0,0,0,0,0,0|1,0,0]=1 9 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)O 90260 [0,0,0,0,0,0|0,0,0]=0 10 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(=O)O 90250 [0,0,0,0,0,0|0,0,0]=0 11 B19R0.149 CCCCCC\C=C/CCCCCCCCCC(=O)O 20023 [0,0,0,0,0,0|0,0,4]=4 12 B19R0.149 CCCCCC\C=C\C=C/CCCCCCCC(=O)O 90140 [0,0,0,0,0,0|0,0,2]=2 13 B19R0.149 CCCCCC\C=C\C=C\CCCCCCCC(=O)O 90370 [0,0,0,0,0,0|0,0,2]=2 14 B19R0.149 CCCCCC\C=C\CCCCCCCCCC(=O)O 15301 [0,0,0,0,0,0|0,0,4]=4 15 B19R0.149 CCCCC\C=C/C=C/C=C\CCCCCCC(=O)O 16036 [0,0,0,0,0,0|0,0,4]=4 16 B19R0.149 CCCCC\C=C/C=C/CCCCCCCCC(=O)O 90145 [0,0,0,0,0,0|0,0,4]=4 17 B19R0.149 CCCCC\C=C/C\C=C/CCCCCCCC(=O)N 21055 [0,0,0,0,0,0|1,0,2]=3 18 B19R0.149 CCCCC\C=C/C\C=C/CCCCCCCC(=O)O 17951 [0,0,0,0,0,0|0,0,2]=2 19 B19R0.149 CCCCC\C=C/C\C=C/CCCCCCCC(=O)O 90150 [0,0,0,0,0,0|0,0,2]=2 20 B19R0.149 CCCCC\C=C/C\C=C/CC\C=C/CCCC(=O)O 10008654 [0,0,0,0,0,0|0,0,4]=4 21 B19R0.149 CCCCC\C=C/C\C=C/C\C=C/CCCCC(=O)O 90220 [0,0,0,0,0,0|0,0,4]=4 22 B19R0.149 CCCCC\C=C\C\C=C\CCCCCCCC(=O)O 90160 [0,0,0,0,0,0|0,0,2]=2 23 B19R0.149 CCCC\C=C\C=C/C=C\CCCCCCCC(=O)O 10008349 [0,0,0,0,0,0|0,0,4]=4 24 B19R0.149 CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)O 90210 [0,0,0,0,0,0|0,0,4]=4 25 B18R0.176 CCCCCCCCCCCCCCCCC(=O)O 19722 [1,0,0,0,0,0|0,0,1]=2 26 B18R0.176 CCCCCC\C=C/CCCCCCCCC(=O)O 19748 [1,0,0,0,0,0|0,0,2]=3 27 B18R0.221 CCCCC\C=C/C\C=C/CCCCCCCCO 16556 [1,0,0,0,0,0|0,0,3]=4 28 B20R0.90 CCCCCC[C@H](C\C=C/CCCCCCCC(=O)O)O 10009369 [0,1,0,0,0,0|0,0,0]=1 29 B20R0.2931 CCCCCCCCCCCCCCCC(=O)CC(=O)O 14807 [0,1,0,0,0,0|0,0,3]=4 30 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)OC 20609 [0,1,0,0,0,0|0,0,2]=3 31 B20R0.3034 CCCCCCCC\C=C/CCCCCCCC(=O)NO 19644 [0,1,0,0,0,0|0,0,0]=1 32 B20R0.3034 CCCCCCCC\C=C/CCCCCCCC(=O)OC 20604 [0,1,0,0,0,0|0,0,0]=1 33 B20R0.17440 CCCCC\C=C/C=C/C(=O)CCCCCCCC(=O)O 38420 [0,1,0,0,0,0|0,0,3]=4 34 B20R0.17440 CCCCC\C=C\C=C\C(=O)CCCCCCCC(=O)O 10685 [0,1,0,0,0,0|0,0,3]=4 35 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)O 19723 [0,1,0,0,0,0|0,0,2]=3 36 B20R0.31940 CCCCCCCC\C=C/CCCCCCCCC(=O)O 19749 [0,1,0,0,0,0|0,0,0]=1 37 B20R0.32990 CCCCCC(=O)\C=C\C=C/CCCCCCCC(=O)O 38620 [0,1,0,0,0,0|0,0,3]=4 38 B20R0.32990 CCCCCC(\C=C\C=C/CCCCCCCC(=O)O)O 38600 [0,1,0,0,0,0|0,0,2]=3 39 B20R0.32990 CCCCC[C@@H](\C=C\C=C/CCCCCCCC(=O)O)O 38610 [0,1,0,0,0,0|0,0,2]=3 40 B20R0.32990 CCCCC[C@H](\C=C\C=C/CCCCCCCC(=O)O)O 38605 [0,1,0,0,0,0|0,0,2]=3 41 B17R0.43 C#CCCCCCCCCCCCCCC(=O)O 13266 [2,0,0,0,0,0|0,0,2]=4 42 B17R0.43 CCCCCCCCCCCCCCCC(=O)N 21086 [2,0,0,0,0,0|1,0,0]=3 43 B17R0.43 CCCCCCCCCCCCCCCC(=O)O 10006627 [2,0,0,0,0,0|0,0,0]=2 44 B17R0.43 CCCCCCCCCCCCC\C=C/C(=O)O 11133 [2,0,0,0,0,0|0,0,2]=4 45 B17R0.43 CCCCCCCCCCCCC\C=C\C(=O)O 11132 [2,0,0,0,0,0|0,0,2]=4 46 B17R0.43 CCCCCCCC\C=C/CCCCCC(=O)O 10007290 [2,0,0,0,0,0|0,0,0]=2 47 B17R0.43 CCCCCC\C=C/CCCCCCCC(=O)O 10009871 [2,0,0,0,0,0|0,0,0]=2 48 B17R0.43 CCCCCC\C=C/CCCCCCCC(=O)[O-] 21911 [2,0,0,0,0,0|0,0,1]=3 49 B17R0.43 CCCCCC\C=C\CCCCCCCC(=O)O 9001798 [2,0,0,0,0,0|0,0,0]=2 50 B21R0.21192 CCCCCC[C@H](C\C=C/CCCCCCCC(=O)OC)O 10009729 [0,2,0,0,0,0|0,0,0]=2 51 B21R0.37067 CCCCC[C@H]([C@H](C\C=C/CCCCCCCC(=O)O)O)O 10009832 [0,2,0,0,0,0|0,0,0]=2 52 B21R0.2907 CCCCCCCCCCCCCCCCCC(=O)OCC 10008196 [0,2,0,0,0,0|0,0,2]=4 53 B21R0.2907 CCCCCCCC\C=C/CCCCCCCC(=O)NCC 10005459 [0,2,0,0,0,0|1,0,0]=3 54 B21R0.2907 CCCCCCCC\C=C/CCCCCCCC(=O)OCC 10008201 [0,2,0,0,0,0|0,0,0]=2 55 B21R0.2907 CCCCC\C=C/C\C=C/CCCCCCCC(=O)OCC 10008198 [0,2,0,0,0,0|0,0,2]=4 56 B21R0.23597 CCCCC[C@@H](\C=C\C=C/CCCCCCCC(=O)OC)O 10008875 [0,2,0,0,0,0|0,0,2]=4 57 B21R0.36766 CCCCCCCCCCCCCCCCCCC(=O)OC 20607 [0,2,0,0,0,0|0,0,2]=4 58 B21R0.81 CCCCCCCCC#CCC#CCCCCCCC(=O)O 90100 [0,2,0,0,0,0|0,0,2]=4 59 B21R0.81 CCCCCCCCCCCCCCCCCCCC(=O)O 9000339 [0,2,0,0,0,0|0,0,2]=4 60 B21R0.81 CCCCCCCCCCCCCCCCC\C=C/C(=O)O 10007602 [0,2,0,0,0,0|0,0,2]=4 61 B21R0.81 CCCCCCCCCCCCCCCCC\C=C\C(=O)O 10007622 [0,2,0,0,0,0|0,0,2]=4 62 B21R0.81 CCCCCCCC\C=C/CCCCCCCCCC(=O)O 20606 [0,2,0,0,0,0|0,0,0]=2 63 B21R0.81 CCCCCCCC\C=C/C\C=C/C\C=C/CCCC(=O)O 90190 [0,2,0,0,0,0|0,0,2]=4 64 B21R0.81 CCCCC\C=C/CCCCCCCCCCCCC(=O)O 10009375 [0,2,0,0,0,0|0,0,2]=4 65 B21R0.81 CCCCC\C=C/CCCC\C=C/CCCCCCC(=O)O 16854 [0,2,0,0,0,0|0,0,2]=4 66 B21R0.81 CCCCC\C=C/C\C=C/CCCCCCCCCC(=O)O 90330 [0,2,0,0,0,0|0,0,2]=4 67 B21R0.81 CCCCC\C=C/C\C=C/CCCC\C=C/CCCC(=O)O 10009999 [0,2,0,0,0,0|0,0,2]=4 68 B21R0.81 CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(=O)O 90230 [0,2,0,0,0,0|0,0,2]=4 69 B21R0.36906 CCCCCC(\C=C\C=C/CCCCCCCC(=O)O)OO 10704 [0,2,0,0,0,0|0,0,2]=4 70 B21R0.36906 CCCCC[C@@H](\C=C\C=C/CCCCCCCC(=O)O)OO 48610 [0,2,0,0,0,0|0,0,2]=4 71 B21R1.633376 CCCCC[C@@H]1[C@@H](O1)C\C=C/CCCCCCCC(=O)O 52450 [0,1,0,1,0,0|0,0,0]=2 72 B21R1.988145 CCCCCCC1CC1CCCCCCCCCC(=O)O 10012556 [0,1,0,1,0,0|0,0,2]=4