0 B19R0.149 CCCCCCCCC#CCCCCCCCC(=O)O HY-W341997 [0,0,0,0,0,0|0,0,2]=2 1 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O HY-B2219 [0,0,0,0,0,0|0,0,0]=0 2 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O HY-B2219R [0,0,0,0,0,0|0,0,0]=0 3 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)O HY-W133900 [0,0,0,0,0,0|0,0,0]=0 4 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] HY-W099569 [0,0,0,0,0,0|0,0,1]=1 5 B19R0.149 CCCCCCCCCCCCCCCCCC(=O)[O-] HY-Y1054 [0,0,0,0,0,0|0,0,1]=1 6 B19R0.149 CCCCCCCCCCCCCCCCCC(N)=O HY-W130610 [0,0,0,0,0,0|1,0,0]=1 7 B19R0.149 CCCCCCCCCCCCCCCCCC(N)=O HY-W130610R [0,0,0,0,0,0|1,0,0]=1 8 B19R0.149 CCCCCCCCCCC\C=C/CCCCC(=O)O HY-113362 [0,0,0,0,0,0|0,0,2]=2 9 B19R0.149 CCCCCCCCCCC\C=C\CCCCC(=O)O HY-W342979 [0,0,0,0,0,0|0,0,2]=2 10 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)Cl HY-W127344 [0,0,0,0,0,0|1,0,2]=3 11 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)O HY-W763560 [0,0,0,0,0,0|0,0,2]=2 12 B19R0.149 CCCCCCCC\C=C/CCCCCCC[13C](=O)O HY-N1446S [0,0,0,0,0,0|0,0,2]=2 13 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(=O)O HY-113016 [0,0,0,0,0,0|0,0,2]=2 14 B19R0.149 CCCCCC\C=C/CCCCCCCCCC(=O)O HY-113427A [0,0,0,0,0,0|0,0,2]=2 15 B19R0.149 CCCCCC\C=C\C=C/CCCCCCCC(=O)O HY-113162 [0,0,0,0,0,0|0,0,4]=4 16 B19R0.149 CCCCC\C=C/C\C=C/CCCCCCCC(=O)O HY-N0729 [0,0,0,0,0,0|0,0,4]=4 17 B19R0.149 CCCCC\C=C/C\C=C/CCCCCCCC(=O)O HY-N0729R [0,0,0,0,0,0|0,0,4]=4 18 B19R0.149 CCCCC\C=C\C\C=C\CCCCCCCC(=O)O HY-W071746 [0,0,0,0,0,0|0,0,4]=4 19 B19R0.149 O=C(O)CCCCCCCCCCCCCCCCO HY-124282 [0,0,0,0,0,0|1,0,0]=1 20 B19R0.149 [N-]=[N+]=NCCCCCCCCCCCCCCC(=O)O HY-151656 [0,0,0,0,0,0|3,0,0]=3 21 B18R0.176 CCCCCCCCCCCCCCCCC(=O)O HY-W004284 [1,0,0,0,0,0|0,0,0]=1 22 B18R0.176 CCCCCCCCCCCCCCCCC(=O)O HY-W004284R [1,0,0,0,0,0|0,0,0]=1 23 B18R0.176 CCCCCCCCCCCCCCSCC(=O)O HY-139040 [1,0,0,0,0,0|1,0,0]=2 24 B18R0.176 CCCCCC\C=C/CCCCCCCCC(=O)O HY-116037 [1,0,0,0,0,0|0,0,2]=3 25 B18R0.176 CCCCCC\C=C\CCCCCCCCC(=O)O HY-116037A [1,0,0,0,0,0|0,0,2]=3 26 B18R0.176 O=C(O)CCCCCCCCCCCCCCCO HY-W068212 [1,0,0,0,0,0|1,0,0]=2 27 B18R0.221 CCCCCCCCCCCCCCCCCC=O HY-W004307 [1,0,0,0,0,0|0,0,0]=1 28 B18R0.221 CCCCCCCCCCCCCCCCCCC HY-N7928 [1,0,0,0,0,0|1,0,1]=3 29 B18R0.221 CCCCCCCCCCCCCCCCCCO HY-Y1809 [1,0,0,0,0,0|0,0,1]=2 30 B18R0.221 CCCCCCCCCCCCCCCCCCO HY-Y1809R [1,0,0,0,0,0|0,0,1]=2 31 B20R0.68 CCCCCCCCC(O)CCCCCCCCC(=O)O HY-W128156 [0,1,0,0,0,0|0,0,0]=1 32 B20R0.90 CCCCCCC(O)CCCCCCCCCCC(=O)O HY-W127329 [0,1,0,0,0,0|0,0,0]=1 33 B20R0.90 CCCCCC[C@@H](O)C\C=C/CCCCCCCC(=O)O HY-N6070 [0,1,0,0,0,0|0,0,2]=3 34 B20R0.90 CCCCCC[C@@H](O)C\C=C/CCCCCCCC(=O)O HY-N6070A [0,1,0,0,0,0|0,0,2]=3 35 B20R0.2931 CCCCCCCCCCCCCCCC(O)CC(=O)O HY-116133 [0,1,0,0,0,0|0,0,0]=1 36 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)OC HY-B1934 [0,1,0,0,0,0|0,0,0]=1 37 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)O[K] HY-W133986 [0,1,0,0,0,0|0,0,0]=1 38 B20R0.3034 CCCCCCCCCCCCCCCCCC(=O)O[Na] HY-W099570 [0,1,0,0,0,0|0,0,0]=1 39 B20R0.3034 CCCCCCCC\C=C/CCCCCCCC(=O)OC HY-N2598 [0,1,0,0,0,0|0,0,2]=3 40 B20R0.3034 CCCCCCCC\C=C/CCCCCCCC(=O)O[Na] HY-N1446B [0,1,0,0,0,0|0,0,2]=3 41 B20R0.3034 CCCCCCCC\C=C\CCCCCCCC(=O)OC HY-N7861 [0,1,0,0,0,0|0,0,2]=3 42 B20R0.3034 CCCCCC\C=C\CCCCCCCCCC(=O)OC HY-134156A [0,1,0,0,0,0|0,0,2]=3 43 B20R0.3034 [Li]OC(=O)CCCCCCCCCCCCCCCCC HY-W099571 [0,1,0,0,0,0|0,0,0]=1 44 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)O HY-W004261 [0,1,0,0,0,0|0,0,0]=1 45 B20R0.31940 CCCCCCCC\C=C/CCCCCCCCC(=O)O HY-113450 [0,1,0,0,0,0|0,0,1]=2 46 B20R0.31940 CCCCCCCC\C=C\CCCCCCCCC(=O)O HY-W718357 [0,1,0,0,0,0|0,0,1]=2 47 B20R0.31940 [N-]=[N+]=NCCCCCCCCCCCCCCCC(=O)O HY-147309 [0,1,0,0,0,0|2,0,0]=3 48 B17R0.43 C(CCCCCC)=CCCCCCCCC(=O)O HY-W011873 [2,0,0,0,0,0|0,0,2]=4 49 B17R0.43 CCCCCCCCCCCCCCCC(=O)O HY-N0830 [2,0,0,0,0,0|0,0,0]=2 50 B17R0.43 CCCCCCCCCCCCCCCC(=O)O HY-N0830R [2,0,0,0,0,0|0,0,0]=2 51 B17R0.43 CCCCCCCCCCCCCCCC(N)=O HY-121389 [2,0,0,0,0,0|1,0,0]=3 52 B17R0.43 CCCCCCCCCCCCCCC[13C](=O)O HY-N0830S3 [2,0,0,0,0,0|0,0,0]=2 53 B17R0.43 CCCCCCCCCCCCCCOC(C)=O HY-W042284 [2,0,0,0,0,0|2,0,0]=4 54 B17R0.43 CCCCCCCCCCCCCC[13CH2][13C](=O)O HY-N0830S10 [2,0,0,0,0,0|0,0,0]=2 55 B17R0.43 CCCCCC\C=C\CCCCCCCC(=O)O HY-N2341 [2,0,0,0,0,0|0,0,2]=4 56 B17R0.43 O=C(O)CCCCCCCCCCCCCCO HY-W105734 [2,0,0,0,0,0|1,0,0]=3 57 B17R0.117 CCCCCCCCCCCCCCCCCC HY-N6600 [2,0,0,0,0,0|0,0,1]=3 58 B17R0.117 CCCCCCCCCCCCCCCCCO HY-W004296 [2,0,0,0,0,0|0,0,0]=2 59 B17R0.117 CCCCCCCCCCCCCOCCCO HY-B2106 [2,0,0,0,0,0|1,0,0]=3 60 B19R0.148 CCCCCCCCCCCCCCCCC(=O)OC HY-W004290 [1,1,0,0,0,0|0,0,0]=2 61 B19R0.443 CC(C)CCCCCCCCCCCCCCC(=O)O HY-W127433 [1,1,0,0,0,0|0,0,0]=2 62 B19R0.443 O=C(O)CCCCCCCCCCCCCCC(=O)O HY-W018161 [1,1,0,0,0,0|1,0,1]=4 63 B19R0.3102 CCCCCCCCCCCCCCCCS(=O)(=O)F HY-125967 [1,1,0,0,0,0|1,0,1]=4 64 B19R0.36 CCCCCCCCCCCCCCCCCCCC HY-W094847 [1,1,0,0,0,0|1,0,1]=4 65 B19R0.36 CCCCCCCCCCCCCCCCOCCO HY-W250466 [1,1,0,0,0,0|0,0,1]=3 66 B21R0.9111 CCCCCCCCC(O)C(O)CCCCCCCC(=O)O HY-N8522 [0,2,0,0,0,0|0,0,0]=2 67 B21R0.9111 CCCCCCCC[C@@H](O)[C@H](O)CCCCCCCC(=O)O HY-W700437 [0,2,0,0,0,0|0,0,0]=2 68 B21R0.9111 CCCCC\C=C/CC(O)C(O)CCCCCCCC(=O)O HY-131670 [0,2,0,0,0,0|0,0,2]=4 69 B21R0.21192 CCCCCCC(O)CCCCCCCCCCC(=O)OC HY-W127376 [0,2,0,0,0,0|0,0,0]=2 70 B21R0.21192 CCCCCC[C@@H](O)C\C=C/CCCCCCCC(=O)OC HY-N8045 [0,2,0,0,0,0|0,0,2]=4 71 B21R0.2907 CCCCCCCCCCCCCCCCCC(=O)OCC HY-W013809 [0,2,0,0,0,0|0,0,0]=2 72 B21R0.2907 CCCCCCCC\C=C/CCCCCCCC(=O)OCC HY-N7103 [0,2,0,0,0,0|0,0,2]=4 73 B21R0.2907 CCCCCCCC\C=C/CCCCCCCC(=O)OCC HY-N7103R [0,2,0,0,0,0|0,0,2]=4 74 B21R0.36766 CCCCCCCCCCCCCCCCCCC(=O)OC HY-W004262 [0,2,0,0,0,0|0,0,0]=2 75 B21R0.36766 CCCCCCCCCCCCCCCCOCC(O)CO HY-W011309 [0,2,0,0,0,0|0,0,2]=4 76 B21R0.36766 CCCCCCCCCCCCCCCCOC[C@@H](O)CO HY-W011309A [0,2,0,0,0,0|0,0,2]=4 77 B21R0.37123 [2H]C([2H])(CCCCCCCCCCCCCCCC)C(=O)O HY-B2219S1 [0,2,0,0,0,0|0,0,0]=2 78 B21R0.36773 CCCCCCCCCCCCCCCC(=O)NCC(=O)O HY-W074890 [0,2,0,0,0,0|0,0,1]=3 79 B21R0.81 CCCCCCCCCCCCCCCCCCCC(=O)O HY-W004260 [0,2,0,0,0,0|0,0,0]=2 80 B21R0.81 CCCCCCCCCCCCCCCCCCCC(=O)O HY-W004260R [0,2,0,0,0,0|0,0,0]=2 81 B21R0.81 CCCCCCCC\C=C/CCCCCCCCCC(=O)O HY-W013242 [0,2,0,0,0,0|0,0,0]=2 82 B21R0.81 CCCCCCCC\C=C\CCCCCCCCCC(=O)O HY-109589A [0,2,0,0,0,0|0,0,0]=2 83 B21R0.81 CCCCCC\C=C/CCCCCCCCCCOC(C)=O HY-128900 [0,2,0,0,0,0|1,0,1]=4 84 B21R0.81 CCCCC\C=C/C\C=C/CCCCCCCCCC(=O)O HY-149589 [0,2,0,0,0,0|0,0,2]=4 85 B21R0.81 CCCCC\C=C\C\C=C\CCCCCCCCCC(=O)O HY-113130 [0,2,0,0,0,0|0,0,2]=4 86 B21R0.9014 O=C(O)CCCCCCCCCCCCCCCCC(=O)O HY-W005178 [0,2,0,0,0,0|0,0,1]=3 87 B21R1.17805 CCCCCCCC[C@H]1O[C@H]1CCCCCCCC(=O)O HY-129554 [0,1,0,1,0,0|0,0,0]=2