0 B20R0.90 CCCCCCC(CCCCCCCCCCC(=O)N)O TS74546 [0,0,1,0,0,0|1,0,2]=4 1 B20R0.90 CCCCCCC(CCCCCCCCCCC(=O)O)O TS74646 [0,0,1,0,0,0|0,0,2]=3 2 B20R0.90 CCCCCCC(CCCCCCCCCCC(=O)O)O TS94285 [0,0,1,0,0,0|0,0,2]=3 3 B20R0.90 CCCCCC[C@H](CC=CCCCCCCCC(=O)O)O TS56063 [0,0,1,0,0,0|0,0,0]=1 4 B20R0.90 CCCCCC[C@H](CC=CCCCCCCCC(=O)O)O TS56064 [0,0,1,0,0,0|0,0,0]=1 5 B20R0.90 CCCCCC[C@H](CC=CCCCCCCCC(=O)[O-])O TS77233 [0,0,1,0,0,0|0,0,1]=2 6 B20R0.31940 CCCCCCCCC=CCCCCCCCCC(=O)O TS65204 [0,0,1,0,0,0|1,0,2]=4 7 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)O TS56070 [0,0,1,0,0,0|1,0,2]=4 8 B20R0.32990 CCCCCC(C=CC=CCCCCCCCC(=O)O)O TS35923 [0,0,1,0,0,0|0,0,2]=3 9 B20R0.32990 CCCCC[C@@H](C=CC=CCCCCCCCC(=O)O)O TS35920 [0,0,1,0,0,0|0,0,2]=3 10 B19R0.149 CCCCCC=CCC=CCCCCCCCC(=O)O TS39920 [1,0,1,0,0,0|0,0,2]=4 11 B19R0.149 CCCCCC=CCC=CCCCCCCCC(=O)O TS54366 [1,0,1,0,0,0|0,0,2]=4 12 B19R0.149 CCCCCC=CCC=CCCCCCCCC(=O)O TS70086 [1,0,1,0,0,0|0,0,2]=4 13 B19R0.149 CCCCCCCC=CCCCCCCCCC(=O)O TS54553 [1,0,1,0,0,0|0,0,2]=4 14 B19R0.149 CCCCCCCCC#CCCCCCCCC(=O)O TS54370 [1,0,1,0,0,0|0,0,2]=4 15 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)Cl TS74658 [1,0,1,0,0,0|1,0,0]=3 16 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)Cl TS74659 [1,0,1,0,0,0|1,0,0]=3 17 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)N TS34358 [1,0,1,0,0,0|1,0,0]=3 18 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)O TS54559 [1,0,1,0,0,0|0,0,0]=2 19 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)O TS54562 [1,0,1,0,0,0|0,0,0]=2 20 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)O TS64263 [1,0,1,0,0,0|0,0,0]=2 21 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)O TS66790 [1,0,1,0,0,0|0,0,0]=2 22 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)O TS80992 [1,0,1,0,0,0|0,0,0]=2 23 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)O TS81972 [1,0,1,0,0,0|0,0,0]=2 24 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)O TS84962 [1,0,1,0,0,0|0,0,0]=2 25 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)[O-] TS61613 [1,0,1,0,0,0|0,0,1]=3 26 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)[O-] TS74547 [1,0,1,0,0,0|0,0,1]=3 27 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)[O-] TS74974 [1,0,1,0,0,0|0,0,1]=3 28 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)[O-] TS75115 [1,0,1,0,0,0|0,0,1]=3 29 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)[O-] TS75769 [1,0,1,0,0,0|0,0,1]=3 30 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)[O-] TS81457 [1,0,1,0,0,0|0,0,1]=3 31 B19R0.149 CCCCCCCCC=CCCCCCCCC(=O)[O-] TS84004 [1,0,1,0,0,0|0,0,1]=3 32 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O TS34775 [1,0,1,0,0,0|0,0,2]=4 33 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O TS54859 [1,0,1,0,0,0|0,0,2]=4 34 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O TS64393 [1,0,1,0,0,0|0,0,2]=4 35 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O TS78613 [1,0,1,0,0,0|0,0,2]=4 36 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O TS93617 [1,0,1,0,0,0|0,0,2]=4 37 B19R0.149 CCCCCCCCCSCCCCCCCC(=O)O TS74817 [1,0,1,0,0,0|1,0,1]=4 38 B19R0.18065 CCCCCC[C@H](CC=CCCCCCCCCO)O TS54775 [1,0,1,0,0,0|0,0,1]=3 39 B21R0.21192 CCCCCC[C@H](CC=CCCCCCCCC(=O)OC)O TS76567 [0,1,1,0,0,0|0,0,0]=2 40 B21R0.36906 CCCCC[C@@H](C=CC=CCCCCCCCC(=O)O)OO TS61018 [0,1,1,0,0,0|0,0,2]=4 41 B23R1.1112145 CCCCC[C@H]1[C@H](O1)CC=CCC=CCC=CCCCC(=O)O TS77253 [0,0,0,0,0,2|0,0,2]=4