0 B14R0.337 CCCCCCCCCCCC(=O)OC TN6895 [0,0,0,0,0,0|0,0,0]=0 1 B14R0.337 COC(=O)CCCCCCCCCCBr T17694 [0,0,0,0,0,0|1,0,0]=1 2 B13R0.54 CCCCCC/C=C\CCCC(O)=O T8240 [1,0,0,0,0,0|0,0,2]=3 3 B13R0.54 CCCCCCCCCCCC(C)=O T9502 [1,0,0,0,0,0|0,0,0]=1 4 B13R0.54 CCCCCCCCCCCC(O)=O T6873 [1,0,0,0,0,0|0,0,0]=1 5 B13R0.54 CCCCCCCCCCCC([O-])=O T30004 [1,0,0,0,0,0|0,0,1]=2 6 B13R0.54 CCCCOCCOCCOC(C)=O T20251 [1,0,0,0,0,0|3,0,0]=4 7 B13R0.54 NCCCCCCCCCCC(O)=O T17323 [1,0,0,0,0,0|1,0,0]=2 8 B13R0.54 OOCCCCCCCCCC(O)=O T33476 [1,0,0,0,0,0|2,0,0]=3 9 B13R0.147 CCCCCCCCCCC(=O)OC T9505 [1,0,0,0,0,0|0,0,0]=1 10 B13R0.147 COC(CCCCCCCCC=C)=O T9296 [1,0,0,0,0,0|0,0,2]=3 11 B13R0.336 CCCCCCCCCCCCCC TN6959 [1,0,0,0,0,0|1,0,1]=3 12 B15R0.81 CCCCCCCCCCCCC(=O)OC TN6919 [0,1,0,0,0,0|0,0,0]=1 13 B15R0.81 COC(=O)CCOCCOCCOCCO T15523 [0,1,0,0,0,0|3,0,0]=4 14 B15R0.172 COC(=O)CCCCCCCCC(=O)OC T21157 [0,1,0,0,0,0|1,0,1]=3 15 B12R0.5 CCCCCCCCC/C=C/C=O TN6927 [2,0,0,0,0,0|0,0,2]=4 16 B12R0.5 CCCCCCCCCCCCO T9514 [2,0,0,0,0,0|0,0,1]=3 17 B12R0.5 CCCCCCCCCCOC=C T31314 [2,0,0,0,0,0|1,0,1]=4 18 B12R0.234 CCCCCCCC/C=C/C(O)=O T19589 [2,0,0,0,0,0|0,0,2]=4 19 B12R0.234 CCCCCCCCCCC(O)=O T3948 [2,0,0,0,0,0|0,0,0]=2 20 B12R0.234 CCCCCCCCCCS(C)=O T29297 [2,0,0,0,0,0|1,0,0]=3 21 B12R0.234 OC(=O)CCCCCCCCC=C T0306 [2,0,0,0,0,0|0,0,2]=4 22 B12R0.234 OCCCCCCCCCC(O)=O TMO2685 [2,0,0,0,0,0|1,0,0]=3 23 B12R0.248 CCCCCCCCCC(=O)NC T31309 [2,0,0,0,0,0|1,0,0]=3 24 B12R0.248 CCCCCCCCCC(=O)NN T31346 [2,0,0,0,0,0|2,0,0]=4 25 B12R0.248 CCCCCCCCCC(=O)NO T33614 [2,0,0,0,0,0|2,0,0]=4 26 B12R0.248 CCCCCCCCCC(=O)OC T33337 [2,0,0,0,0,0|0,0,0]=2 27 B14R0.68 OC(=O)CCCCCCCCCC(O)=O T5565 [1,1,0,0,0,0|1,0,1]=4 28 B14R0.88 CCCCCCCCCCOP(O)([O-])=O T29032 [1,1,0,0,0,0|2,0,0]=4 29 B14R0.88 OP(O)(=O)CCCCCCCCCCBr T13999 [1,1,0,0,0,0|2,0,0]=4 30 B14R0.305 COC(=O)CCCCCCCCC(O)=O T21236 [1,1,0,0,0,0|1,0,1]=4 31 B14R0.340 NCCCCNCCCC[C@H](N)C(O)=O T31380 [1,1,0,0,0,0|2,0,0]=4 32 B14R0.391 CCCCCCCCCC(O)CC(O)=O T19120 [1,1,0,0,0,0|0,0,0]=2 33 B14R0.394 CCCCCCCCCCCCC(O)=O T3950 [1,1,0,0,0,0|0,0,0]=2 34 B14R0.394 OCCCCCCCCCCCC(O)=O T4879 [1,1,0,0,0,0|0,0,0]=2 35 B14R0.197 COC(=O)CCCCCCCC(=O)OC TN6921 [1,1,0,0,0,0|1,0,1]=4 36 B14R0.392 CCCCCCCCCCCCCCC TN6759 [1,1,0,0,0,0|1,0,1]=4 37 B14R0.392 CCCCCCCCCCCCCCO TN6991 [1,1,0,0,0,0|1,0,1]=4 38 B16R0.70 CCCCCCCCCCCC(=O)C(O)CC T32537 [0,2,0,0,0,0|1,0,0]=3 39 B16R0.221 CCCC/C=C\CCCCCCCC(=O)OC TN7013 [0,2,0,0,0,0|0,0,0]=2 40 B16R0.221 CCCCCCCCCCCCCC(=O)OC TN6901 [0,2,0,0,0,0|0,0,0]=2 41 B16R0.222 CCCCCCCCCCOCC(OC)OC T31313 [0,2,0,0,0,0|0,0,2]=4 42 B16R1.8816 O=C1CCCCCCCCCCCCCC1 T7978 [0,1,0,1,0,0|1,0,0]=3 43 B16R1.26934 CCCCCC1C(CC(=O)OC)CCC1=O T2783 [0,1,0,1,0,0|0,0,1]=3