0 B19R0.149 BrCCCCCCCCCCCCCCCCC(=O)O 1P000VOG [0,0,0,0,0,0|1,0,2]=3 1 B19R0.149 C#CCCCCCCCCCCCCCCCC(=O)O 1P00334T [0,0,0,0,0,0|0,0,4]=4 2 B19R0.149 C#CCCCCCC\C=C/CCCCCCCC(=O)O 1P01E2QM [0,0,0,0,0,0|0,0,2]=2 3 B19R0.149 C#CCCC\C=C/C\C=C/CCCCCCCC(=O)O 1P01EQ3W [0,0,0,0,0,0|0,0,4]=4 4 B19R0.149 CCCCCC#CCC#CCCCCCCCC(=O)O 1P002DQ2 [0,0,0,0,0,0|0,0,4]=4 5 B19R0.149 CCCCCC=CCC=CCCCCCCCC(=O)N 1P00BKEX [0,0,0,0,0,0|1,0,2]=3 6 B19R0.149 CCCCCC=CCC=CCCCCCCCC(=O)[O-] 1P008LP4 [0,0,0,0,0,0|0,0,3]=3 7 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)Cl 1P003TXX [0,0,0,0,0,0|1,0,0]=1 8 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)C 1P003IA1 [0,0,0,0,0,0|1,0,2]=3 9 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)Cl 1P00362Y [0,0,0,0,0,0|1,0,2]=3 10 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)F 1P001NK3 [0,0,0,0,0,0|1,0,2]=3 11 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)N 1P003TWQ [0,0,0,0,0,0|1,0,2]=3 12 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O 1P003A0N [0,0,0,0,0,0|0,0,2]=2 13 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O 1P007MZT [0,0,0,0,0,0|0,0,2]=2 14 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O 1P00BY4H [0,0,0,0,0,0|0,0,2]=2 15 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P0001OL [0,0,0,0,0,0|0,0,3]=3 16 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P0038MM [0,0,0,0,0,0|0,0,3]=3 17 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P003O9E [0,0,0,0,0,0|0,0,3]=3 18 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P003OG6 [0,0,0,0,0,0|0,0,3]=3 19 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P003P55 [0,0,0,0,0,0|0,0,3]=3 20 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P003R1T [0,0,0,0,0,0|0,0,3]=3 21 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P003RPS [0,0,0,0,0,0|0,0,3]=3 22 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P003RSM [0,0,0,0,0,0|0,0,3]=3 23 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P003RVY [0,0,0,0,0,0|0,0,3]=3 24 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P003TJT [0,0,0,0,0,0|0,0,3]=3 25 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P003UDZ [0,0,0,0,0,0|0,0,3]=3 26 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P003VUY [0,0,0,0,0,0|0,0,3]=3 27 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P007K03 [0,0,0,0,0,0|0,0,3]=3 28 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P008LP5 [0,0,0,0,0,0|0,0,3]=3 29 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] 1P00H981 [0,0,0,0,0,0|0,0,3]=3 30 B19R0.149 CCCCCCCCCCCCCCCCC[13C](=O)O 1P008I0Q [0,0,0,0,0,0|0,0,2]=2 31 B19R0.149 CCCCCCCCCCCCCCCCNC(=O)C 1P0039EC [0,0,0,0,0,0|2,0,2]=4 32 B19R0.149 CCCCCCCCCCCCCCCCOC(=O)C 1P00E9YQ [0,0,0,0,0,0|2,0,2]=4 33 B19R0.149 CCCCCCCCCCCCCCCCOC(=O)Cl 1P002T0M [0,0,0,0,0,0|2,0,2]=4 34 B19R0.149 CCCCCCCCCCC\C=C\CCCCC(=O)O 1P00EG1W [0,0,0,0,0,0|0,0,4]=4 35 B19R0.149 CCCCCCCCC\C=C/CCCCCCC(=O)O 1P01IISJ [0,0,0,0,0,0|0,0,2]=2 36 B19R0.149 CCCCCCCCSCCCCCCCCC(=O)O 1P007XJO [0,0,0,0,0,0|1,0,1]=2 37 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)N 1P0037VE [0,0,0,0,0,0|1,0,0]=1 38 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)O 1P0011YG [0,0,0,0,0,0|0,0,0]=0 39 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)O 1P003UVF [0,0,0,0,0,0|0,0,0]=0 40 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)O 1P009RBY [0,0,0,0,0,0|0,0,0]=0 41 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)O 1P00HTH6 [0,0,0,0,0,0|0,0,0]=0 42 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)O 1P01FLI3 [0,0,0,0,0,0|0,0,0]=0 43 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)[O-] 1P001OFH [0,0,0,0,0,0|0,0,1]=1 44 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)[O-] 1P003UDJ [0,0,0,0,0,0|0,0,1]=1 45 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)[O-] 1P007KNE [0,0,0,0,0,0|0,0,1]=1 46 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)[O-] 1P009AV3 [0,0,0,0,0,0|0,0,1]=1 47 B19R0.149 CCCCCCCC\C=C/CCCCCCC[13C](=O)O 1P00G5LP [0,0,0,0,0,0|0,0,0]=0 48 B19R0.149 CCCCCCCC\C=C/[13CH2][13CH2]CCC[13CH2][13CH2][13C](=O)O 1P027JY4 [0,0,0,0,0,0|0,0,0]=0 49 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(=O)N 1P00DE1D [0,0,0,0,0,0|1,0,0]=1 50 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(=O)O 1P0079CD [0,0,0,0,0,0|0,0,0]=0 51 B19R0.149 CCCCCC\C=C/C=C\CCCCCCCC(=O)O 1P01EQJM [0,0,0,0,0,0|0,0,2]=2 52 B19R0.149 CCCCCC\C=C/CCCCCCCCCC(=O)O 1P00D9IR [0,0,0,0,0,0|0,0,4]=4 53 B19R0.149 CCCCCC\C=C\C=C/CCCCCCCC(=O)O 1P007NRV [0,0,0,0,0,0|0,0,2]=2 54 B19R0.149 CCCCCC\C=C\C=C/CCCCCCCC(=O)[O-] 1P01LIY8 [0,0,0,0,0,0|0,0,3]=3 55 B19R0.149 CCCCCC\C=C\C=C\CCCCCCCC(=O)O 1P00DAQX [0,0,0,0,0,0|0,0,2]=2 56 B19R0.149 CCCCCC\C=C\CCCCCCCCCC(=O)O 1P003VG1 [0,0,0,0,0,0|0,0,4]=4 57 B19R0.149 CCCCC\C=C/C=C/C=C/CCCCCCC(=O)O 1P00DPS6 [0,0,0,0,0,0|0,0,4]=4 58 B19R0.149 CCCCC\C=C/C=C/C=C\CCCCCCC(=O)O 1P002XDK [0,0,0,0,0,0|0,0,4]=4 59 B19R0.149 CCCCC\C=C/C=C/CCCCCCCCC(=O)O 1P006XM5 [0,0,0,0,0,0|0,0,4]=4 60 B19R0.149 CCCCC\C=C/C\C=C/CCCCCCCC(=O)Cl 1P003RR5 [0,0,0,0,0,0|1,0,2]=3 61 B19R0.149 CCCCC\C=C/C\C=C/CCCCCCCC(=O)N 1P00D0KE [0,0,0,0,0,0|1,0,2]=3 62 B19R0.149 CCCCC\C=C/C\C=C/CCCCCCCC(=O)O 1P0039VM [0,0,0,0,0,0|0,0,2]=2 63 B19R0.149 CCCCC\C=C/C\C=C/CC\C=C/CCCC(=O)O 1P00AQSF [0,0,0,0,0,0|0,0,4]=4 64 B19R0.149 CCCCC\C=C/C\C=C/C\C=C/CCCCC(=O)O 1P0035FD [0,0,0,0,0,0|0,0,4]=4 65 B19R0.149 CCCCC\C=C/C\C=C\CCCCCCCC(=O)O 1P006XM6 [0,0,0,0,0,0|0,0,2]=2 66 B19R0.149 CCCCC\C=C\C\C=C\CCCCCCCC(=O)O 1P006XSM [0,0,0,0,0,0|0,0,2]=2 67 B19R0.149 CCCC\C=C/C=C/C=C\CCCCCCCC(=O)O 1P00DJIE [0,0,0,0,0,0|0,0,4]=4 68 B19R0.149 CCCC\C=C/CCCCCCCCCCCC(=O)O 1P000W9L [0,0,0,0,0,0|0,0,4]=4 69 B19R0.149 CCCC\C=C\C=C\C=C/CCCCCCCC(=O)O 1P00DAQY [0,0,0,0,0,0|0,0,4]=4 70 B19R0.149 CCCC\C=C\C=C\C=C\CCCCCCCC(=O)O 1P00DJX8 [0,0,0,0,0,0|0,0,4]=4 71 B19R0.149 CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)O 1P003972 [0,0,0,0,0,0|0,0,4]=4 72 B19R0.149 OCCCCCCCCCCCCCCCCC(=O)O 1P000VOH [0,0,0,0,0,0|1,0,2]=3 73 B18R0.176 BrCCCCCCCCCCCCCCCC(=O)O 1P003EC6 [1,0,0,0,0,0|1,0,1]=3 74 B18R0.176 C=CCCCCCCCCCCCCCCC(=O)O 1P00EFYS [1,0,0,0,0,0|0,0,3]=4 75 B18R0.176 CCCCCCCCCCCCCCCCC(=O)Cl 1P003RX1 [1,0,0,0,0,0|1,0,1]=3 76 B18R0.176 CCCCCCCCCCCCCCCCC(=O)N 1P00BTC5 [1,0,0,0,0,0|1,0,1]=3 77 B18R0.176 CCCCCCCCCCCCCCCCC(=O)O 1P00DF67 [1,0,0,0,0,0|0,0,1]=2 78 B18R0.176 CCCCCCCCCCCCCCCCC(=O)O 1P00GRRW [1,0,0,0,0,0|0,0,1]=2 79 B18R0.176 CCCCCCCCCCCCCCCCC(=O)[O-] 1P001ZN2 [1,0,0,0,0,0|0,0,2]=3 80 B18R0.176 CCCCCCCCCCCCCCCOC(=O)C 1P003U1I [1,0,0,0,0,0|2,0,1]=4 81 B18R0.176 CCCCCCCCCCCCCCSCC(=O)O 1P002Y6F [1,0,0,0,0,0|1,0,1]=3 82 B18R0.176 CCCCCCC\C=C/CCCCCCCC(=O)O 1P01SNM1 [1,0,0,0,0,0|0,0,0]=1 83 B18R0.176 CCCCCC\C=C/CCCCCCCCC(=O)O 1P002ZQZ [1,0,0,0,0,0|0,0,2]=3 84 B18R0.176 CCCCCC\C=C\CCCCCCCCC(=O)O 1P000TNK [1,0,0,0,0,0|0,0,2]=3 85 B18R0.176 NCCCCCCCCCCCCCCCC(=O)O 1P01QI9A [1,0,0,0,0,0|1,0,1]=3 86 B18R0.176 OCCCCCCCCCCCCCCCC(=O)O 1P003ECA [1,0,0,0,0,0|1,0,1]=3 87 B18R0.176 SCCCCCCCCCCCCCCCC(=O)O 1P003ECB [1,0,0,0,0,0|1,0,1]=3 88 B18R0.221 CCCCCC=CCC=CCCCCCCCC=O 1P002U27 [1,0,0,0,0,0|0,0,2]=3 89 B18R0.221 CCCCCCCCCCCCCCCCCC=C 1P003F1A [1,0,0,0,0,0|1,0,2]=4 90 B18R0.221 CCCCCCCCCCCCCCCCCC=O 1P00EEEK [1,0,0,0,0,0|0,0,2]=3 91 B18R0.221 CCCCCCCCCCCCCCCCCCO 1P0033AE [1,0,0,0,0,0|0,0,3]=4 92 B18R0.221 CCCCCCCC\C=C/CCCCCCCC=O 1P0039RA [1,0,0,0,0,0|0,0,0]=1 93 B18R0.221 CCCCCCCC\C=C/CCCCCCCCBr 1P003TXZ [1,0,0,0,0,0|1,0,1]=3 94 B18R0.221 CCCCCCCC\C=C/CCCCCCCCN 1P0035W6 [1,0,0,0,0,0|1,0,1]=3 95 B18R0.221 CCCCCCCC\C=C/CCCCCCCCN 1P01V3IH [1,0,0,0,0,0|1,0,1]=3 96 B18R0.221 CCCCCCCC\C=C/CCCCCCCCO 1P006WPH [1,0,0,0,0,0|0,0,1]=2 97 B18R0.221 CCCCCCCC\C=C\CCCCCCCCO 1P003VFB [1,0,0,0,0,0|0,0,1]=2 98 B18R0.221 CCCCC\C=C/C\C=C/CCCCCCCC=O 1P00BVUS [1,0,0,0,0,0|0,0,2]=3 99 B18R0.221 CCCCC\C=C/C\C=C/CCCCCCCCO 1P003PDW [1,0,0,0,0,0|0,0,3]=4 100 B20R0.68 CCCCCCCCC(=O)CCCCCCCCC(=O)O 1P0039JS [0,1,0,0,0,0|0,0,1]=2 101 B20R0.68 CCCCCCCCC(CCCCCCCCC(=O)O)O 1P00334K [0,1,0,0,0,0|0,0,2]=3 102 B20R0.68 CCCCCCCC[C@@H](\C=C\CCCCCCC(=O)O)O 1P01LITC [0,1,0,0,0,0|0,0,2]=3 103 B20R0.68 CCCCC\C=C/CC(=O)CCCCCCCCC(=O)O 1P027JXA [0,1,0,0,0,0|0,0,3]=4 104 B20R0.90 CCCCCCC(=O)CCCCCCCCCCC(=O)O 1P00GWOZ [0,1,0,0,0,0|0,0,3]=4 105 B20R0.90 CCCCCCC(CCCCCCCCCCC(=O)O)O 1P003BHL [0,1,0,0,0,0|0,0,2]=3 106 B20R0.90 CCCCCCC(CCCCCCCCCCC(=O)O)O 1P00G6PZ [0,1,0,0,0,0|0,0,2]=3 107 B20R0.90 CCCCCCC(CCCCCCCCCCC(=O)[O-])O 1P001OL3 [0,1,0,0,0,0|0,0,3]=4 108 B20R0.90 CCCCCC[C@H](C\C=C/CCCCCCCC(=O)O)O 1P001G6E [0,1,0,0,0,0|0,0,0]=1 109 B20R0.90 CCCCCC[C@H](C\C=C/CCCCCCCC(=O)[O-])O 1P003ULK [0,1,0,0,0,0|0,0,1]=2 110 B20R0.90 CCCCCC[C@H](C\C=C/CCCCCCCC(=O)[O-])O 1P003VUV [0,1,0,0,0,0|0,0,1]=2 111 B20R0.90 CCCCCC[C@H](C\C=C\CCCCCCCC(=O)O)O 1P00E0UH [0,1,0,0,0,0|0,0,0]=1 112 B20R0.90 CCCCCC[C@H](C\C=C\CCCCCCCC(=O)[O-])O 1P01XDFG [0,1,0,0,0,0|0,0,1]=2 113 B20R0.2931 CCCCCCCCCCCCCCCC(=O)CC(=O)O 1P00AQU4 [0,1,0,0,0,0|0,0,3]=4 114 B20R0.2931 CCCCCCCCCCCCCCCC(CC(=O)O)O 1P0025YH [0,1,0,0,0,0|0,0,2]=3 115 B20R0.3034 CCCCCCCCC=CCCCCCCCC(=O)NO 1P007HEW [0,1,0,0,0,0|0,0,0]=1 116 B20R0.3034 CCCCCCCCC=CCCCCCCCC(=O)OC 1P002P9T [0,1,0,0,0,0|0,0,0]=1 117 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)NC 1P0028F2 [0,1,0,0,0,0|1,0,2]=4 118 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)NN 1P003UVZ [0,1,0,0,0,0|1,0,2]=4 119 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)OC 1P003SJA [0,1,0,0,0,0|0,0,2]=3 120 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)O[Ag] 1P003UQ9 [0,1,0,0,0,0|0,0,2]=3 121 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)O[Al] 1P005J12 [0,1,0,0,0,0|0,0,2]=3 122 B20R0.3034 CCCCCCCC\C=C/CCCCCCCC(=O)OC 1P007T70 [0,1,0,0,0,0|0,0,0]=1 123 B20R0.3034 CCCCCCCC\C=C\CCCCCCCC(=O)OC 1P003QDU [0,1,0,0,0,0|0,0,0]=1 124 B20R0.3034 CCCCCC\C=C/C=C\CCCCCCCC(=O)OC 1P0056WE [0,1,0,0,0,0|0,0,2]=3 125 B20R0.3034 CCCCCC\C=C\C=C/CCCCCCCC(=O)OC 1P000V4O [0,1,0,0,0,0|0,0,2]=3 126 B20R0.3034 CCCCCC\C=C\C=C\CCCCCCCC(=O)OC 1P00A1WS [0,1,0,0,0,0|0,0,2]=3 127 B20R0.3034 CCCCC\C=C/C\C=C/CCCCCCCC(=O)OC 1P003SHG [0,1,0,0,0,0|0,0,2]=3 128 B20R0.3034 CCCCC\C=C\C\C=C\CCCCCCCC(=O)OC 1P00I5D7 [0,1,0,0,0,0|0,0,2]=3 129 B20R0.3034 OCCCCCCCCCCCCCCCCC(=O)OC 1P005WB9 [0,1,0,0,0,0|1,0,2]=4 130 B20R0.3037 C#CCCCCCCC=CCCCCCCC(C(=O)O)O 1P00722F [0,1,0,0,0,0|0,0,2]=3 131 B20R0.3037 CCCCCCCCCCCCCCCCC(C(=O)O)Br 1P001HZS [0,1,0,0,0,0|0,0,2]=3 132 B20R0.3037 CCCCCCCCCCCCCCCCC(C(=O)O)Cl 1P01EQT3 [0,1,0,0,0,0|0,0,2]=3 133 B20R0.3037 CCCCCCCCCCCCCCCCC(C(=O)O)F 1P001Q6M [0,1,0,0,0,0|0,0,2]=3 134 B20R0.3037 CCCCCCCCCCCCCCCCC(C(=O)O)O 1P0011YJ [0,1,0,0,0,0|0,0,2]=3 135 B20R0.3037 CCCCCCCC\C=C/CCCCCCC(C(=O)O)O 1P003HWI [0,1,0,0,0,0|0,0,0]=1 136 B20R0.10422 CCCCCCCCCCCC(=O)CCCCCC(=O)O 1P001XH1 [0,1,0,0,0,0|0,0,3]=4 137 B20R0.17440 CCCCCCCCCC(=O)CCCCCCCC(=O)O 1P00D6H2 [0,1,0,0,0,0|0,0,1]=2 138 B20R0.17440 CCCCC\C=C\C=C\C(=O)CCCCCCCC(=O)O 1P00DMHZ [0,1,0,0,0,0|0,0,3]=4 139 B20R0.26099 CCC(CCCCCCCCCCCCCCC(=O)O)C 1P00AKSE [0,1,0,0,0,0|0,0,2]=3 140 B20R0.31940 BrCCCCCCCCCCCCCCCCCC(=O)O 1P01G86X [0,1,0,0,0,0|0,0,2]=3 141 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)N 1P0037XV [0,1,0,0,0,0|1,0,2]=4 142 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)O 1P00E9WU [0,1,0,0,0,0|0,0,2]=3 143 B20R0.31940 CCCCCCCCCCCCCCCCCOC(=O)C 1P003RBB [0,1,0,0,0,0|1,0,2]=4 144 B20R0.31940 CCCCCCCC\C=C/CCCCCCCCC(=O)O 1P00FEJ9 [0,1,0,0,0,0|0,0,0]=1 145 B20R0.31940 OCCCCCCCCCCCCCCCCCC(=O)O 1P01KKQC [0,1,0,0,0,0|0,0,2]=3 146 B20R0.31940 SCCCCCCCCCCCCCCCCCC(=O)O 1P01IQ7D [0,1,0,0,0,0|0,0,2]=3 147 B20R0.32990 CCCCCC(=O)CCCCCCCCCCCC(=O)O 1P01X6G0 [0,1,0,0,0,0|0,0,3]=4 148 B20R0.32990 CCCCCC(CCCCCCCCCCCC(=O)O)O 1P0025YG [0,1,0,0,0,0|0,0,2]=3 149 B20R0.32990 CCCCCC(\C=C\C=C\CCCCCCCC(=O)O)O 1P00B6QH [0,1,0,0,0,0|0,0,2]=3 150 B20R0.35227 CC(CCCCCCCCCCCCCCCC(=O)O)C 1P00BCBG [0,1,0,0,0,0|0,0,2]=3 151 B20R1.3309 CCCCCCCCCCCCCCC1CCC(=O)O1 1P0037LY [0,0,0,1,0,0|0,0,2]=3 152 B17R0.43 BrCCCCCCCCCCCCCCC(=O)O 1P00EHD7 [2,0,0,0,0,0|1,0,0]=3 153 B17R0.43 C#CCCCCCCCCCCCCCC(=O)O 1P005TGP [2,0,0,0,0,0|0,0,2]=4 154 B17R0.43 C#CCCCC\C=C/CCCCCCCC(=O)O 1P01EQPA [2,0,0,0,0,0|0,0,2]=4 155 B17R0.43 C=CCCCCCCCCCCCCCC(=O)O 1P01I4CB [2,0,0,0,0,0|0,0,2]=4 156 B17R0.43 CCCCC=CCCCCCCCCCC(=O)O 1P006XDF [2,0,0,0,0,0|0,0,2]=4 157 B17R0.43 CCCCCCCCCCCCCCCC(=O)C 1P002Y8B [2,0,0,0,0,0|1,0,0]=3 158 B17R0.43 CCCCCCCCCCCCCCCC(=O)N 1P003RCB [2,0,0,0,0,0|1,0,0]=3 159 B17R0.43 CCCCCCCCCCCCCCCC(=O)O 1P002SZ6 [2,0,0,0,0,0|0,0,0]=2 160 B17R0.43 CCCCCCCCCCCCCCCC(=O)O 1P003A0I [2,0,0,0,0,0|0,0,0]=2 161 B17R0.43 CCCCCCCCCCCCCCCC(=O)[O-] 1P003U08 [2,0,0,0,0,0|0,0,1]=3 162 B17R0.43 CCCCCCCCCCCCCCCC(O)C 1P001YBI [2,0,0,0,0,0|1,0,1]=4 163 B17R0.43 CCCCCCCCCCCCCCC[13C](=O)O 1P003U0A [2,0,0,0,0,0|0,0,0]=2 164 B17R0.43 CCCCCCCCCCCCCCOC(=O)C 1P00E9YX [2,0,0,0,0,0|2,0,0]=4 165 B17R0.43 CCCCCCCCCCCCCC[13CH2]C(=O)O 1P00BF47 [2,0,0,0,0,0|0,0,0]=2 166 B17R0.43 CCCCCCCCCCCCC\C=C/C(=O)O 1P00BERM [2,0,0,0,0,0|0,0,2]=4 167 B17R0.43 CCCCCCCCCCCCC\C=C\C(=O)O 1P003HTN [2,0,0,0,0,0|0,0,2]=4 168 B17R0.43 CCCCCCCCCCCCSCCC(=O)O 1P001E9O [2,0,0,0,0,0|1,0,0]=3 169 B17R0.43 CCCCCCCCCCCC[13CH2][13CH2][13CH2][13C](=O)O 1P01LJ38 [2,0,0,0,0,0|0,0,0]=2 170 B17R0.43 CCCCCCCCC\C=C/CCCCC(=O)O 1P00B28P [2,0,0,0,0,0|0,0,2]=4 171 B17R0.43 CCCCCCCC\C=C/CCCCCC(=O)O 1P00BEQD [2,0,0,0,0,0|0,0,0]=2 172 B17R0.43 CCCCCC\C=C/CCCCCCCC(=O)Cl 1P00BXYE [2,0,0,0,0,0|1,0,0]=3 173 B17R0.43 CCCCCC\C=C/CCCCCCCC(=O)N 1P0038SU [2,0,0,0,0,0|1,0,0]=3 174 B17R0.43 CCCCCC\C=C/CCCCCCCC(=O)O 1P00I7TD [2,0,0,0,0,0|0,0,0]=2 175 B17R0.43 CCCCCC\C=C/CCCCCCCC(=O)[O-] 1P00FUL6 [2,0,0,0,0,0|0,0,1]=3 176 B17R0.43 CCCCCC\C=C\CCCCCCCC(=O)O 1P0001ZR [2,0,0,0,0,0|0,0,0]=2 177 B17R0.43 NCCCCCCCCCCCCCCC(=O)O 1P00203I [2,0,0,0,0,0|1,0,0]=3 178 B17R0.43 OCCCCCCCCCCCCCCC(=O)O 1P003EC4 [2,0,0,0,0,0|1,0,0]=3 179 B17R0.117 CCCCCCCCCCCCCCCCC=C 1P0033AF [2,0,0,0,0,0|1,0,1]=4 180 B17R0.117 CCCCCCCCCCCCCCCCC=O 1P003RB9 [2,0,0,0,0,0|0,0,1]=3 181 B17R0.117 CCCCCCCCCCCCCCCCCO 1P001LBZ [2,0,0,0,0,0|0,0,2]=4 182 B19R0.35 CCCCCCCCCCCCCCC(CC(=O)O)O 1P0075HQ [1,1,0,0,0,0|0,0,1]=3 183 B19R0.59 CCCCCCCC(=O)CCCCCCCCC(=O)O 1P020N8K [1,1,0,0,0,0|0,0,1]=3 184 B19R0.148 BrCCCCCCCCCCCCCCCC(=O)OC 1P003S0F [1,1,0,0,0,0|1,0,1]=4 185 B19R0.148 CCCCCCCCCCCCCCCCC(=O)OC 1P001Z3G [1,1,0,0,0,0|0,0,1]=3 186 B19R0.148 CCCCCC\C=C/CCCCCCCCC(=O)OC 1P003SGJ [1,1,0,0,0,0|0,0,2]=4 187 B19R0.148 OCCCCCCCCCCCCCCCC(=O)OC 1P01HYD6 [1,1,0,0,0,0|1,0,1]=4 188 B19R0.443 CC(CCCCCCCCCCCCCCC(=O)O)C 1P0030G1 [1,1,0,0,0,0|0,0,1]=3 189 B19R0.3102 CCCCCCCCCCCCCCCCP(=O)(O)O 1P003RCI [1,1,0,0,0,0|1,0,1]=4 190 B19R0.26214 CCCCCCCCCC(=O)CCCCCCC(=O)O 1P024I0V [1,1,0,0,0,0|0,0,1]=3 191 B19R0.26214 CCCCCCCCCC(CCCCCCC(=O)O)O 1P024HAV [1,1,0,0,0,0|0,0,1]=3 192 B19R0.26289 CCCCCCC(=O)CCCCCCCCCC(=O)O 1P024HIK [1,1,0,0,0,0|0,0,2]=4 193 B19R0.26289 CCCCCCC(CCCCCCCCCC(=O)O)O 1P024I27 [1,1,0,0,0,0|0,0,1]=3 194 B21R0.9111 CCCCCCCCC(C(CCCCCCCC(=O)O)[2H])[2H] 1P01LJ9B [0,2,0,0,0,0|0,0,2]=4 195 B21R0.10777 CCCCCCCCC(=O)CCCCCCCCC(=O)OC 1P0036TN [0,2,0,0,0,0|0,0,1]=3 196 B21R0.10777 CCCCCCCCC(CCCCCCCCC(=O)OC)O 1P006V04 [0,2,0,0,0,0|0,0,2]=4 197 B21R0.32823 CCCCCCCC[C@@H](\C=C\[C@H](CCCCCC(=O)O)O)O 1P023Z9V [0,2,0,0,0,0|0,0,2]=4 198 B21R0.36685 CCCCCCCCCC(=O)CCCCCCCCC(=O)O 1P00GRLF [0,2,0,0,0,0|0,0,1]=3 199 B21R0.21192 CCCCCCC(CCCCCCCCCCC(=O)OC)O 1P001G6D [0,2,0,0,0,0|0,0,2]=4 200 B21R0.21192 CCCCCC[C@H](C\C=C/CCCCCCCC(=O)OC)O 1P001G6C [0,2,0,0,0,0|0,0,0]=2 201 B21R0.36393 CCCCCCCCCCCCCCCC(CC(=O)OC)O 1P007OJW [0,2,0,0,0,0|0,0,2]=4 202 B21R0.2907 CCCCCCCCCCCCCCCCCC(=O)OC=C 1P008S24 [0,2,0,0,0,0|0,0,2]=4 203 B21R0.2907 CCCCCCCCCCCCCCCCCC(=O)OCC 1P003QXL [0,2,0,0,0,0|0,0,2]=4 204 B21R0.2907 CCCCCCCC\C=C/CCCCCCCC(=O)OCC 1P0082GZ [0,2,0,0,0,0|0,0,0]=2 205 B21R0.2907 CCCCCCCC\C=C/CCCCCCCC(=O)[N-]CC 1P008H57 [0,2,0,0,0,0|1,0,0]=3 206 B21R0.2907 CCCCC\C=C/C\C=C/CCCCCCCC(=O)OCC 1P003QWC [0,2,0,0,0,0|0,0,2]=4 207 B21R0.2907 CCCCC\C=C\C\C=C\CCCCCCCC(=O)OCC 1P00EG1S [0,2,0,0,0,0|0,0,2]=4 208 B21R0.2929 CCCCCCCCCC(=O)CCCCCCCC(=O)OC 1P0038OC [0,2,0,0,0,0|0,0,1]=3 209 B21R0.23597 CCCCC[C@@H](\C=C\C=C/CCCCCCCC(=O)OC)O 1P008T7J [0,2,0,0,0,0|0,0,2]=4 210 B21R0.30140 COC(=O)CCCCCCCCCCCCCCCC(C)C 1P00DGJR [0,2,0,0,0,0|0,0,2]=4 211 B21R0.36766 CCCCCCCCCCCCCCCCCCC(=O)OC 1P001Z3F [0,2,0,0,0,0|0,0,2]=4 212 B21R0.36766 CCCCCCCC\C=C/CCCCCCCCC(=O)OC 1P002BLD [0,2,0,0,0,0|0,0,0]=2 213 B21R0.37123 CCCCCCCCCCCCCCCCC(C(=O)O)([2H])[2H] 1P00AQ16 [0,2,0,0,0,0|0,0,2]=4 214 B21R0.81 BrCCCCCCCCCCCCCCCCCCC(=O)O 1P008OAP [0,2,0,0,0,0|0,0,2]=4 215 B21R0.81 CCCCCC=CCC=CCCCCCCCCCC(=O)O 1P002KI7 [0,2,0,0,0,0|0,0,2]=4 216 B21R0.81 CCCCCCCCCCCCCCCCCC=CC(=O)O 1P006EQH [0,2,0,0,0,0|0,0,2]=4 217 B21R0.81 CCCCCCCCCCCCCCCCCCCC(=O)O 1P0036OO [0,2,0,0,0,0|0,0,2]=4 218 B21R0.81 CCCCCCCCCCCCCCCCC\C=C\C(=O)O 1P01FGPN [0,2,0,0,0,0|0,0,2]=4 219 B21R0.81 CCCCCCCCCCC\C=C/CCCCCCC(=O)O 1P0057HD [0,2,0,0,0,0|0,0,2]=4 220 B21R0.81 CCCCCCCCCC\C=C/CCCCCCCC(=O)O 1P002Y4M [0,2,0,0,0,0|0,0,0]=2 221 B21R0.81 CCCCCCCC\C=C/CCCCCCCCCC(=O)O 1P003PEC [0,2,0,0,0,0|0,0,0]=2 222 B21R0.81 CCCCCCCC\C=C/C\C=C/C\C=C/CCCC(=O)O 1P002AVK [0,2,0,0,0,0|0,0,2]=4 223 B21R0.81 CCCCCCCC\C=C\CCCCCCCCCC(=O)O 1P00EBLI [0,2,0,0,0,0|0,0,0]=2 224 B21R0.81 CCCCCC\C=C/CCCCCCCCCCCC(=O)O 1P0025QW [0,2,0,0,0,0|0,0,2]=4 225 B21R0.81 CCCCC\C=C/CCCCCCCCCCCCC(=O)O 1P01FGPZ [0,2,0,0,0,0|0,0,2]=4 226 B21R0.81 CCCCC\C=C/CCCC\C=C/CCCCCCC(=O)O 1P009C3N [0,2,0,0,0,0|0,0,2]=4 227 B21R0.81 CCCCC\C=C/C\C=C/CCCCCCCCCC(=O)O 1P00DXYH [0,2,0,0,0,0|0,0,2]=4 228 B21R0.81 CCCCC\C=C/C\C=C/CCCC\C=C/CCCC(=O)O 1P00FBZ7 [0,2,0,0,0,0|0,0,2]=4 229 B21R0.81 CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(=O)O 1P0026DG [0,2,0,0,0,0|0,0,2]=4 230 B21R0.81 OCCCCCCCCCCCCCCCCCCC(=O)O 1P01XDAX [0,2,0,0,0,0|0,0,2]=4 231 B21R0.9014 OC(=O)CCCCCCCC=CCCCCCCCC(=O)O 1P00DK5R [0,2,0,0,0,0|0,0,1]=3 232 B21R0.19042 CCCCC\C=C/[C@@H](\C=C/[C@@H](CCCCCCC(=O)O)O)O 1P01LJHR [0,2,0,0,0,0|0,0,2]=4 233 B21R0.36906 CCCCCC(C=CC=CCCCCCCCC(=O)O)OO 1P00C02G [0,2,0,0,0,0|0,0,2]=4 234 B21R0.36906 CCCCCC(\C=C\C=C/CCCCCCCC(=O)O)OO 1P002MCE [0,2,0,0,0,0|0,0,2]=4 235 B21R1.17805 CCCCCCCCC1=C(C1)CCCCCCCC(=O)O 1P008Q5N [0,1,0,1,0,0|0,0,0]=2 236 B21R1.17805 CCCCCCCCC1OC1CCCCCCCC(=O)O 1P00C2UY [0,1,0,1,0,0|0,0,2]=4 237 B21R1.17805 CCCCCCCC[C@H]1C[C@H]1CCCCCCCC(=O)O 1P00DEUT [0,1,0,1,0,0|0,0,2]=4