0 B11R0.148 CCCCCCC\C=C\C(=O)O D89593 [0,0,0,0,0,0|0,0,4]=4 1 B11R0.148 CCCCCC\C=C\CC(=O)O D89807 [0,0,0,0,0,0|0,0,2]=2 2 B10R0.4 CCCCCCCC[C@H](C)O D89844 [1,0,0,0,0,0|1,0,2]=4 3 B10R0.4 CCCCCC\C=C\C(C)=O 74304 [1,0,0,0,0,0|1,0,2]=4 4 B10R0.4 CCCCC\C=C\CC(=O)O T72443 [1,0,0,0,0,0|0,0,0]=1 5 B10R0.4 CCCC\C=C\COC(C)=O D88386 [1,0,0,0,0,0|2,0,0]=3 6 B10R0.4 NCCCCCCCC(=O)O 52149 [1,0,0,0,0,0|1,0,1]=3 7 B10R0.71 C=CCCCCCCCCC D92764 [1,0,0,0,0,0|1,0,2]=4 8 B10R0.71 C=C\C=C\C=C\CCCCC D92769 [1,0,0,0,0,0|1,0,2]=4 9 B10R0.71 CCCCC\C=C\C=C\CO D89948 [1,0,0,0,0,0|0,0,3]=4 10 B10R0.71 CCCC\C=C\CCCCO D90170 [1,0,0,0,0,0|0,0,3]=4 11 B12R0.119 CCCCCCCCCP(=O)(O)O T72505 [0,1,0,0,0,0|1,0,2]=4 12 B12R0.251 CCCCCCCC[C@H](O)C(=O)O F14658 [0,1,0,0,0,0|0,0,2]=3 13 B9R0.2 CCCCCCC[13C](=O)O 41418 [2,0,0,0,0,0|0,0,0]=2 14 B9R0.2 CCCCCCC[13C](=O)[O-] 41397 [2,0,0,0,0,0|0,0,1]=3 15 B9R0.2 CCCCCCC[C@H](C)O D97855 [2,0,0,0,0,0|1,0,1]=4 16 B9R0.2 CCCCC\C=C\C(=O)O D91783 [2,0,0,0,0,0|0,0,0]=2 17 B9R0.2 CCCCC\C=C\C(C)=O D91739 [2,0,0,0,0,0|1,0,0]=3 18 B9R0.2 CCCC\C=C\CC(=O)O D84200 [2,0,0,0,0,0|0,0,0]=2 19 B9R0.45 CCCCCC#CCCO D91697 [2,0,0,0,0,0|0,0,2]=4 20 B9R0.45 CCCCCC\C=C\CO D91737 [2,0,0,0,0,0|0,0,2]=4 21 B9R0.45 CCCCC\C=C/CCO D91738 [2,0,0,0,0,0|0,0,0]=2 22 B9R0.45 CCCC\C=C/CCCC T71292 [2,0,0,0,0,0|1,0,1]=4 23 B9R0.45 CC\C=C\C\C=C\CCO D91741 [2,0,0,0,0,0|0,0,2]=4 24 B11R0.30 O=C(O)CC\C=C\CCC(=O)O 44449 [1,1,0,0,0,0|1,0,1]=4 25 B11R0.40 CCCCCCCCC(=O)CC D92753 [1,1,0,0,0,0|1,0,1]=4 26 B11R0.3 CCCC\C=C\CCCCCC T71264 [1,1,0,0,0,0|1,0,1]=4 27 B13R0.147 COC(=O)CCCCCCCCCBr D94757 [0,2,0,0,0,0|0,0,2]=4 28 B13R0.2 CCCCC\C=C\CCC(=O)OCC D89947 [0,2,0,0,0,0|0,0,0]=2 29 B11R1.91 O=C(O)CCN1CCNCC1 A12371 [1,0,0,1,0,0|2,0,0]=4 30 B11R1.91 O=C(O)CC[C@H]1CCCCN1 33375 [1,0,0,1,0,0|1,0,1]=4 31 B11R1.91 O=C(O)CC[C@H]1CCCNC1 28918 [1,0,0,1,0,0|1,0,1]=4 32 B11R1.91 O=C(O)\C=C\C1=CCCCC1 C16172 [1,0,0,1,0,0|0,0,2]=4 33 B11R1.143 CN1CCCCC[C@H]1C(=O)O 63138 [1,0,0,1,0,0|1,0,1]=4 34 B11R1.180 CCCCCC1=CCCC1=O D84134 [1,0,0,1,0,0|0,0,0]=2 35 B13R1.45 O=C(O)CCC(=O)N1CCOCC1 F11803 [0,1,0,1,0,0|2,0,0]=4 36 B13R1.45 O=C(O)CNC(=O)C1CCCCC1 F21119 [0,1,0,1,0,0|1,0,1]=4 37 B13R1.344 O=C(O)CCC(=O)NC1CCCC1 F11768 [0,1,0,1,0,0|1,0,0]=3