0 B18R0.176 CCCCCCC\C=C\CCCCCCCC(=O)O C16536 [0,0,0,0,0,0|1,0,2]=3 1 B18R0.176 O=C(O)CCCCCCCCCCCCCCCF C13948 [0,0,0,0,0,0|1,0,0]=1 2 B18R0.176 O=C(O)CCCCCCCCCCCCCCCO C18218 [0,0,0,0,0,0|0,0,0]=0 3 B18R0.176 O=CCCCCCCCCCCCCCCC(=O)O C19614 [0,0,0,0,0,0|0,0,2]=2 4 B17R0.43 CCCCCCCCCCCCCCCC(=O)O C00249 [1,0,0,0,0,0|0,0,0]=1 5 B17R0.43 CCCCCC\C=C/CCCCCCCC(=O)O C08362 [1,0,0,0,0,0|0,0,2]=3 6 B19R0.59 O=C(O)CCCCCCCCC(O)CCCCCCO C08285 [0,1,0,0,0,0|0,0,0]=1 7 B19R0.149 CCCCCCCCC#CCCCCCCCC(=O)O C08459 [0,1,0,0,0,0|1,0,1]=3 8 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O C01530 [0,1,0,0,0,0|1,0,0]=2 9 B19R0.149 CCCCCCCCCCCCCCCCCC(N)=O C13846 [0,1,0,0,0,0|2,0,0]=3 10 B19R0.149 CCCCCCCCCCC\C=C/CCCCC(=O)O C08363 [0,1,0,0,0,0|1,0,1]=3 11 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)O C00712 [0,1,0,0,0,0|1,0,1]=3 12 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)[O-] C18601 [0,1,0,0,0,0|1,0,2]=4 13 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(N)=O C19670 [0,1,0,0,0,0|2,0,1]=4 14 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(=O)O C01712 [0,1,0,0,0,0|1,0,1]=3 15 B19R0.149 CCCCCC\C=C\CCCCCCCCCC(=O)O C08367 [0,1,0,0,0,0|1,0,1]=3 16 B19R0.443 CC(C)CCCCCCCCCCCCCCC(=O)O C20356 [0,1,0,0,0,0|1,0,0]=2 17 B19R0.443 O=C(O)CCCCCCCCCCCCCCC(=O)O C19615 [0,1,0,0,0,0|0,0,1]=2 18 B19R1.25715 O=C(O)CCCCCCCCCCC1CCCCC1 C12100 [0,0,0,1,0,0|1,0,0]=2 19 B16R0.274 CCCCCCCCCCCCCCC(=O)O C16537 [2,0,0,0,0,0|0,0,0]=2 20 B16R0.303 CCCCCCCCCCCCCCCC=O C00517 [2,0,0,0,0,0|0,0,0]=2 21 B16R0.303 CCCCCCCCCCCCCCCCC C01816 [2,0,0,0,0,0|1,0,1]=4 22 B16R0.303 CCCCCCCCCCCCCCCCO C00823 [2,0,0,0,0,0|0,0,1]=3 23 B16R0.303 CCCCCCCCCCCCC\C=C\C=O C06123 [2,0,0,0,0,0|0,0,2]=4 24 B18R0.171 CCCCCCCCCCCCCCCC(=O)OC C16995 [1,1,0,0,0,0|0,0,0]=2 25 B18R0.171 [*]SC(=O)CCCCCCCCCCCCCCC C05764 [1,1,0,0,0,0|0,1,0]=3 26 B18R0.974 CC(=O)NCCCCCCCCCCCCC(C)C C17515 [1,1,0,0,0,0|2,0,0]=4 27 B18R0.221 CCCCCCCCCCCCCCCCCC=O C01838 [1,1,0,0,0,0|1,0,0]=3 28 B20R0.68 CCCCCCCCC(C)CCCCCCCCC(=O)O C16794 [0,2,0,0,0,0|1,0,0]=3 29 B20R0.68 CCCCCCCC[C@@H](O)CCCCCCCCC(=O)O C03195 [0,2,0,0,0,0|1,0,0]=3 30 B20R0.3034 CCCCCCCC\C=C/CCCCCCCC(=O)OC C03425 [0,2,0,0,0,0|1,0,1]=4 31 B20R0.3034 [*]SC(=O)CCCCCCCCCCCCCCCCC C04088 [0,2,0,0,0,0|1,1,0]=4 32 B20R0.3037 CCCCCCCCCCCCCCCCC(=O)C(=O)O C00869 [0,2,0,0,0,0|1,0,0]=3 33 B20R0.3037 CCCCCCCCCCCCCCCC[C@@H](O)C(=O)O C03042 [0,2,0,0,0,0|1,0,0]=3 34 B20R0.3037 CCCCCCCCCCCCCCCC[C@H](O)C(=O)O C03045 [0,2,0,0,0,0|1,0,0]=3 35 B20R0.90 CCCCCC[C@@H](O)C\C=C/CCCCCCCC(=O)O C08365 [0,2,0,0,0,0|1,0,1]=4 36 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)O C16535 [0,2,0,0,0,0|1,0,0]=3 37 B20R0.31940 O=C(O)CCCCCCC\C=C/CCCCCCCCO C19616 [0,2,0,0,0,0|0,0,0]=2 38 B20R0.31940 O=CCCCCCCC\C=C/CCCCCCCC(=O)O C19617 [0,2,0,0,0,0|0,0,2]=4 39 B20R0.35227 CC(C)CCCCCCCCC\C=C/CCCCC(=O)O C13787 [0,2,0,0,0,0|1,0,1]=4 40 B18R1.20697 O=C(O)CCCCCCCCCC[C@H]1C=CCC1 C16795 [1,0,0,1,0,0|0,0,2]=4 41 B20R1.34039 CCCCCCCCC1=C(CCCCCCC(=O)O)C1 C08321 [0,1,0,1,0,0|1,0,1]=4 42 B20R1.31096 O=C(O)CCCCCCCCCCCC[C@@H]1C=CCC1 C08282 [0,1,0,1,0,0|1,0,0]=3 43 B20R1.688472 O=C(O)CCCCCCCCCCC1CCCCCC1 C12103 [0,1,0,1,0,0|1,0,0]=3 44 B20R1.3479157 CC(=O)CCCCCCCCCCC1CCC(O)C1O C14996 [0,1,0,1,0,0|1,0,0]=3 45 B20R1.3479157 O=C(O)CCCCCCCCCCC1CCC(O)C1O C14987 [0,1,0,1,0,0|0,0,0]=2