0 B17R0.43 BrCCCCCCCCCCCCCCC(=O)O Amb16231526 [0,0,0,0,0,0|1,0,2]=3 1 B17R0.43 C#CCCCCCCCCCCCCCC(O)=O Amb22642012 [0,0,0,0,0,0|0,0,4]=4 2 B17R0.43 CCCCCCCCCCCCCCCC(=O)S Amb22056243 [0,0,0,0,0,0|0,1,2]=3 3 B17R0.43 CCCCCCCCCCCCCCCC(=S)O Amb15691801 [0,0,0,0,0,0|0,1,2]=3 4 B17R0.43 CCCCCCCCCCCCCCCC(O)=O Amb22348427 [0,0,0,0,0,0|0,0,2]=2 5 B17R0.43 CCCCCCCCCCCCCCCC(O)=O Amb22349954 [0,0,0,0,0,0|0,0,2]=2 6 B17R0.43 CCCCCCCCCCCCCCCC([O-])=O Amb22350518 [0,0,0,0,0,0|0,0,3]=3 7 B17R0.43 CCCCCCCCCCCCCCCC([O-])=O Amb22361255 [0,0,0,0,0,0|0,0,3]=3 8 B17R0.43 CCCCCCCCCCCCCCCC([O-])=O Amb22730103 [0,0,0,0,0,0|0,0,3]=3 9 B17R0.43 CCCCCCCCCCCCCCCC([O-])=O Amb22732179 [0,0,0,0,0,0|0,0,3]=3 10 B17R0.43 CCCCCCCCCCCCCCCC([O-])=O Amb22732274 [0,0,0,0,0,0|0,0,3]=3 11 B17R0.43 CCCCCCCCCCCCCCC[13C](O)=O Amb21928730 [0,0,0,0,0,0|0,0,2]=2 12 B17R0.43 CCCCCCCCCCCCCCC[13C]([O-])=O Amb22338989 [0,0,0,0,0,0|0,0,3]=3 13 B17R0.43 CCCCCCCCCCCCCCC[14C](O)=O Amb22352207 [0,0,0,0,0,0|0,0,2]=2 14 B17R0.43 CCCCCCCCCCCCCCOC(=O)Cl Amb22002450 [0,0,0,0,0,0|2,0,2]=4 15 B17R0.43 CCCCCCCCCCCCCC[13CH2]C(O)=O Amb22337967 [0,0,0,0,0,0|0,0,2]=2 16 B17R0.43 CCCCCCCCCCCCCC[13CH2][13C](O)=O Amb22363190 [0,0,0,0,0,0|0,0,2]=2 17 B17R0.43 CCCCCCCCCCCCC\C=C\C(O)=O Amb22732588 [0,0,0,0,0,0|0,0,4]=4 18 B17R0.43 CCCCCCCCCCCCSCCC(=O)N Amb1150923 [0,0,0,0,0,0|2,0,2]=4 19 B17R0.43 CCCCCCCCCCCCSCCC(=O)O Amb1038996 [0,0,0,0,0,0|1,0,2]=3 20 B17R0.43 CCCCCCCCCCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22369000 [0,0,0,0,0,0|0,0,2]=2 21 B17R0.43 CCCCCCCCC\C=C/CCCCC(O)=O Amb21928725 [0,0,0,0,0,0|0,0,2]=2 22 B17R0.43 CCCCCCCCSCCCCCCC(=O)O Amb1038998 [0,0,0,0,0,0|1,0,1]=2 23 B17R0.43 CCCCCCCC\C=C/CCCCCC(O)=O Amb21928726 [0,0,0,0,0,0|0,0,0]=0 24 B17R0.43 CCCCCCCC\C=C\CCCCOC(C)=O Amb22731395 [0,0,0,0,0,0|2,0,0]=2 25 B17R0.43 CCCCCC\C=C\CCCCCCCC(O)=O Amb22729016 [0,0,0,0,0,0|0,0,4]=4 26 B17R0.43 CCCCC\C=C\C\C=C\C\C=C\CC[14C](O)=O Amb21928738 [0,0,0,0,0,0|0,0,4]=4 27 B17R0.43 CCCC\C=C/CCCCCCCCCC(O)=O Amb21928729 [0,0,0,0,0,0|0,0,4]=4 28 B17R0.43 CC\C=C/C\C=C/C\C=C/CCCCCC(O)=O Amb19746735 [0,0,0,0,0,0|0,0,4]=4 29 B17R0.43 OC(=O)CCCCCCCCCCCCCCS Amb22336885 [0,0,0,0,0,0|1,0,2]=3 30 B17R0.43 [13CH3]CCCCCCCCCCCCCCC(O)=O Amb22367411 [0,0,0,0,0,0|0,0,2]=2 31 B17R0.43 [13CH3]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C(O)=O Amb22367412 [0,0,0,0,0,0|0,0,2]=2 32 B17R0.43 [13CH3]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C[13CH2]C([O-])=O Amb22362703 [0,0,0,0,0,0|0,0,3]=3 33 B17R0.43 [13CH3][13CH2]CCCCCCCCCCCCCC(O)=O Amb22367398 [0,0,0,0,0,0|0,0,2]=2 34 B17R0.43 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13C](O)=O Amb22353663 [0,0,0,0,0,0|0,0,2]=2 35 B16R0.274 C=CCCCCCCCCCCCCC(O)=O Amb22489917 [1,0,0,0,0,0|0,0,3]=4 36 B16R0.274 CCCCCCCCCCCCCCC(C)=O Amb22055377 [1,0,0,0,0,0|1,0,1]=3 37 B16R0.274 CCCCCCCCCCCCCOC(C)=O Amb22352318 [1,0,0,0,0,0|2,0,1]=4 38 B16R0.274 CCCCCCCCCCCCSCC(=O)O Amb1085920 [1,0,0,0,0,0|1,0,1]=3 39 B16R0.274 CCCCCCCCCCNCCCC(O)=O Amb20622364 [1,0,0,0,0,0|1,0,1]=3 40 B16R0.274 CCCCCCCCCCNCCCC(O)=O Amb22059079 [1,0,0,0,0,0|1,0,1]=3 41 B16R0.274 CCCCCC\C=C/CCCCCCC(C)=O Amb21617902 [1,0,0,0,0,0|1,0,2]=4 42 B16R0.274 CCCC\C=C/CCCCCCCCC(O)=O Amb21929003 [1,0,0,0,0,0|0,0,3]=4 43 B16R0.274 CCCC\C=C\CCCCCCCCC(O)=O Amb21929004 [1,0,0,0,0,0|0,0,3]=4 44 B16R0.274 OCCCCCCCCCCCCCC(O)=O Amb22489916 [1,0,0,0,0,0|1,0,1]=3 45 B16R0.303 CCCCCCCC\C=C/CCCCCC=O Amb22732373 [1,0,0,0,0,0|0,0,0]=1 46 B16R0.303 CCCCCCCC\C=C/CCCCCCO Amb22740009 [1,0,0,0,0,0|0,0,1]=2 47 B16R0.303 CCCCCCCC\C=C\CCCCCCC Amb22353093 [1,0,0,0,0,0|1,0,1]=3 48 B18R0.114 CCC(C)CCCCCCCCCCCCC(O)=O Amb21928810 [0,1,0,0,0,0|0,0,2]=3 49 B18R0.114 OC(=O)CCCCCCCCCCCCC(F)CBr Amb22547627 [0,1,0,0,0,0|1,0,2]=4 50 B18R0.127 CCCCCCC(C)CCCCCCCCC(O)=O Amb21928809 [0,1,0,0,0,0|0,0,2]=3 51 B18R0.171 CCCCCCCCC\C=C/CCCCC(=O)OC Amb21928728 [0,1,0,0,0,0|0,0,2]=3 52 B18R0.171 CCCCCCCC\C=C/CCCCCC(=O)OC Amb21928815 [0,1,0,0,0,0|0,0,0]=1 53 B18R0.171 COC(=O)CCCCCCCCCCCCCCO Amb21928838 [0,1,0,0,0,0|1,0,2]=4 54 B18R0.174 CCCCCCCCCCCCCCC(Br)C(O)=O Amb17836476 [0,1,0,0,0,0|0,0,2]=3 55 B18R0.174 CCCCCCCCCCCCCCC(C)C(O)=O Amb22731051 [0,1,0,0,0,0|0,0,2]=3 56 B18R0.174 CCCCCCCCCCCCCCC(F)C(O)=O Amb22489952 [0,1,0,0,0,0|0,0,2]=3 57 B18R0.174 CCCCCCCCCCCCCCC(N)C(O)=O Amb21520308 [0,1,0,0,0,0|0,0,2]=3 58 B18R0.174 CCCCCCCCCCCCSC[C@@H](N)C(O)=O Amb23926718 [0,1,0,0,0,0|1,0,2]=4 59 B18R0.176 C=CCCCCCCCCCCCCCCC(=O)O Amb10071540 [0,1,0,0,0,0|0,0,3]=4 60 B18R0.176 CCCCCCCCCCCCCCCCC(=O)Cl Amb20672053 [0,1,0,0,0,0|1,0,2]=4 61 B18R0.176 CCCCCCCCCCCCCCCCC(C)=O Amb22350513 [0,1,0,0,0,0|1,0,2]=4 62 B18R0.176 CCCCCCCCCCCCCCCCC(O)=O Amb22338458 [0,1,0,0,0,0|0,0,2]=3 63 B18R0.176 CCCCCCCCCCCCCCCCC([O-])=O Amb22357986 [0,1,0,0,0,0|0,0,3]=4 64 B18R0.176 CCCCCCCCCCCCCCCCC([O-])=O Amb22728751 [0,1,0,0,0,0|0,0,3]=4 65 B18R0.176 CCCCCCCCCCCCCCCOC(C)=O Amb22350236 [0,1,0,0,0,0|1,0,2]=4 66 B18R0.176 CCCCCC\C=C\CCCCCCCCC(O)=O Amb21928721 [0,1,0,0,0,0|0,0,3]=4 67 B18R0.176 OC(=O)CCCCCCCCCCCCCCCS Amb22336970 [0,1,0,0,0,0|0,0,2]=3 68 B18R0.176 OCCCCCCC\C=C/C\C=C/CCCC(O)=O Amb19928333 [0,1,0,0,0,0|1,0,1]=3 69 B18R0.182 CCCCCCCCCCCCCCCP(O)(O)=O Amb22831962 [0,1,0,0,0,0|1,0,2]=4 70 B18R0.220 CCCCCCCCCCCCCC(O)CC(O)=O Amb21928751 [0,1,0,0,0,0|0,0,2]=3 71 B18R0.974 CC(C)CCCCCCCCCCCCCC(O)=O Amb21928811 [0,1,0,0,0,0|0,0,2]=3 72 B18R0.11628 CCCCCCCCCC(=O)NCCCCC(=O)O Amb1017171 [0,1,0,0,0,0|1,0,1]=3 73 B18R0.17430 CCCCCCCCCCC(O)CCCCC(O)=O Amb23496195 [0,1,0,0,0,0|0,0,2]=3 74 B18R0.19183 CCCCCCCCCCCCS(=O)CCC(=O)O Amb1085922 [0,1,0,0,0,0|1,0,2]=4 75 B18R1.10603 OC(=O)CCCCC\C=C/COC1CCCCO1 Amb22367641 [0,0,0,1,0,0|2,0,0]=3 76 B18R1.13791 O=C1CCCCCC=CCCCCCCCCO1 Amb22168166 [0,0,0,1,0,0|0,0,0]=1 77 B18R1.13791 O=C1CCCCCCCCOCCCCCCO1 Amb22489915 [0,0,0,1,0,0|1,0,2]=4 78 B15R0.70 CCCCCCCCCCCCCCC=O Amb16233570 [2,0,0,0,0,0|0,0,1]=3 79 B15R0.70 CCCCCCCC\C=C\CCCCC=C Amb22353094 [2,0,0,0,0,0|0,0,1]=3 80 B15R0.70 CCCCCCC\C=C\CCCCCCC Amb10560815 [2,0,0,0,0,0|1,0,1]=4 81 B15R0.164 C#CCCCCCCCCCCCC(O)=O Amb22642011 [2,0,0,0,0,0|0,0,2]=4 82 B15R0.164 CCCCCCCCCCCCCC(=C)Br Amb19886462 [2,0,0,0,0,0|2,0,0]=4 83 B15R0.164 CCCCCCCCCCCCCC(C)=C Amb19886459 [2,0,0,0,0,0|2,0,0]=4 84 B15R0.164 CCCCCCCCCCCCCC(C)=O Amb21962426 [2,0,0,0,0,0|1,0,0]=3 85 B15R0.164 CCCCCCCCCCCCCC([O-])=O Amb22348346 [2,0,0,0,0,0|0,0,1]=3 86 B15R0.164 CCCCCCCCCCCCCC([O-])=O Amb22730152 [2,0,0,0,0,0|0,0,1]=3 87 B15R0.164 CCCCCCCCCCCCC[13C](=O)Cl Amb22367510 [2,0,0,0,0,0|1,0,0]=3 88 B15R0.164 CCCCCCCCCCCCC[13C](O)=O Amb22351789 [2,0,0,0,0,0|0,0,0]=2 89 B15R0.164 CCCCCCCCCCCCNC(=O)C Amb10560436 [2,0,0,0,0,0|2,0,0]=4 90 B15R0.164 CCCCCCCCCCCCOC(=O)Cl Amb22002629 [2,0,0,0,0,0|2,0,0]=4 91 B15R0.164 CCCCCCCCCCCC[13CH2][13C](O)=O Amb22338404 [2,0,0,0,0,0|0,0,0]=2 92 B15R0.164 CCCCCCCCCCNCCC(O)=O Amb20630815 [2,0,0,0,0,0|1,0,0]=3 93 B15R0.164 CCCCCCCCCCNCCC(O)=O Amb22059078 [2,0,0,0,0,0|1,0,0]=3 94 B15R0.164 CCCCCCCCCCSCCC(=O)O Amb1036580 [2,0,0,0,0,0|1,0,0]=3 95 B15R0.164 CCCCCCCCSCCCCC(=O)O Amb1038997 [2,0,0,0,0,0|1,0,0]=3 96 B15R0.164 CCCCCC\C=C\CCCCOC(C)=O Amb22730203 [2,0,0,0,0,0|2,0,0]=4 97 B15R0.164 CCCC\C=C\CCCCCCCC(O)=O Amb22350221 [2,0,0,0,0,0|0,0,2]=4 98 B15R0.164 CNCCCCCCCCCCCC(O)=O Amb22350069 [2,0,0,0,0,0|1,0,0]=3 99 B15R0.164 OCCCCCCCCCCCCC(O)=O Amb21935785 [2,0,0,0,0,0|1,0,0]=3 100 B15R0.164 ONCCCCCCCCCCCC(O)=O Amb22364339 [2,0,0,0,0,0|2,0,0]=4 101 B15R0.164 [13CH3]CCCCCCCCCCCCC(O)=O Amb22367443 [2,0,0,0,0,0|0,0,0]=2 102 B17R0.38 CCCCCCCCCCC(=O)CCCC(=O)O Amb2228129 [1,1,0,0,0,0|0,0,2]=4 103 B17R0.101 CCCCCCCOC(=O)CCSCCC(=O)O Amb10564136 [1,1,0,0,0,0|2,0,0]=4 104 B17R0.116 CCCCCCCCCCCCC(O)CC(O)=O Amb21928756 [1,1,0,0,0,0|0,0,1]=3 105 B17R0.195 CCCCCCCCCCCCCCC(=O)CBr Amb22047393 [1,1,0,0,0,0|1,0,1]=4 106 B17R0.195 CCCCCCCCCCNCCCC(=O)OC Amb20622600 [1,1,0,0,0,0|1,0,1]=4 107 B17R0.195 CCCCCCCCCCNCCCC(=O)OC Amb22157193 [1,1,0,0,0,0|1,0,1]=4 108 B17R0.197 CCCCCCCCCCCCCCP(O)(O)=O Amb22053907 [1,1,0,0,0,0|1,0,1]=4 109 B17R0.1713 CC(CCCCCC\C=C/CCCCC(=O)O)C Amb15770008 [1,1,0,0,0,0|0,0,0]=2 110 B17R0.14363 CCC(=O)CCCCCCCCCCCC(O)=O Amb22347589 [1,1,0,0,0,0|0,0,2]=4 111 B17R0.14363 CCC(C)CCCCCCCCCCCC(O)=O Amb21928870 [1,1,0,0,0,0|0,0,1]=3 112 B17R0.14363 CCC(C)CCCCC\C=C/CCCCC(O)=O Amb19928281 [1,1,0,0,0,0|0,0,0]=2 113 B17R0.117 CCCCCCCCCCCCCCCCC=O Amb17939324 [1,1,0,0,0,0|0,0,2]=4 114 B17R0.117 CCCCCCCC\C=C\CCCCCCCC Amb20240675 [1,1,0,0,0,0|1,0,1]=4 115 B17R0.117 OCCCCCCC\C=C/CCCCCCCO Amb22641808 [1,1,0,0,0,0|1,0,1]=4 116 B19R0.26214 CCCCCCCCCC(=O)NCCCCCC(=O)O Amb1039625 [0,2,0,0,0,0|0,0,1]=3 117 B19R0.3040 CCCC(F)CCCCCCCSCCCCC(O)=O Amb20241157 [0,2,0,0,0,0|0,0,2]=4 118 B19R0.21221 CCC(C)CCCCCCCCCCCCC(=O)OC Amb21928856 [0,2,0,0,0,0|0,0,2]=4 119 B19R0.14260 CCCCCCC(C)CCCCCCCCC(=O)OC Amb21928855 [0,2,0,0,0,0|0,0,2]=4 120 B19R0.26168 [2H]C(CCCCCCCC(O)=O)C([2H])CCCCCC Amb21928734 [0,2,0,0,0,0|0,0,2]=4 121 B19R0.148 BrCCCCCCCCCCCCCCCC(=O)OC Amb10071547 [0,2,0,0,0,0|0,0,2]=4 122 B19R0.148 CCCCCCCCCC\C=C/CCCCC(=O)OC Amb22731087 [0,2,0,0,0,0|0,0,2]=4 123 B19R0.182 CCCCCCCCCCCCCCCC(=O)OC=C Amb17672566 [0,2,0,0,0,0|0,0,2]=4 124 B19R0.3096 CCCCCCCCCCCCCC(O)CC(=O)OC Amb21928830 [0,2,0,0,0,0|0,0,2]=4 125 B19R0.21384 CCC(C)CCCCCCCCCCCCCC(O)=O Amb21928806 [0,2,0,0,0,0|0,0,2]=4 126 B19R0.21384 COC(=O)CCCCCCCCCCCCCC(C)C Amb21928857 [0,2,0,0,0,0|0,0,2]=4 127 B19R0.25650 CCCCCCCCCCCCCCC(O)C(=O)OC Amb21928829 [0,2,0,0,0,0|0,0,2]=4 128 B19R0.25812 [2H]C([2H])(CCCCCCCCCCCCCC)C(O)=O Amb21928732 [0,2,0,0,0,0|0,0,2]=4 129 B19R0.35 CCCCCCCCCCCCCCC(O)CC(O)=O Amb21928750 [0,2,0,0,0,0|0,0,2]=4 130 B19R0.149 C#CCCCCCCCCCCCCCCCC(O)=O Amb19930518 [0,2,0,0,0,0|0,0,2]=4 131 B19R0.149 CCCCCC#CCCCCCCCCCCC(O)=O Amb22350041 [0,2,0,0,0,0|0,0,2]=4 132 B19R0.149 CCCCCC#CC\C=C/CCCCCCCC(O)=O Amb21928954 [0,2,0,0,0,0|0,0,2]=4 133 B19R0.149 CCCCCCCCCCC#CCCCCCC(=O)O Amb10072581 [0,2,0,0,0,0|0,0,2]=4 134 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22336663 [0,2,0,0,0,0|0,0,2]=4 135 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22352822 [0,2,0,0,0,0|0,0,2]=4 136 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22353520 [0,2,0,0,0,0|0,0,2]=4 137 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22360658 [0,2,0,0,0,0|0,0,2]=4 138 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22360670 [0,2,0,0,0,0|0,0,2]=4 139 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22731026 [0,2,0,0,0,0|0,0,2]=4 140 B19R0.149 CCCCCCCCCCCCCCCCCC(O)=O Amb22735002 [0,2,0,0,0,0|0,0,2]=4 141 B19R0.149 CCCCCCCCCCCCCCCCC[13C](=O)O Amb17620144 [0,2,0,0,0,0|0,0,2]=4 142 B19R0.149 CCCCCCCCCCCCCCCCC[14C](O)=O Amb22352519 [0,2,0,0,0,0|0,0,2]=4 143 B19R0.149 CCCCCCCCCCCCCCCC[13CH2]C(O)=O Amb22367350 [0,2,0,0,0,0|0,0,2]=4 144 B19R0.149 CCCCCCCCCCCCCCCC[13CH2][13C](O)=O Amb22367511 [0,2,0,0,0,0|0,0,2]=4 145 B19R0.149 CCCCCCCCCCCCSCCCCC(=O)O Amb1150949 [0,2,0,0,0,0|0,0,2]=4 146 B19R0.149 CCCCCCCCCCC\C=C/CCCCC(O)=O Amb22350254 [0,2,0,0,0,0|0,0,2]=4 147 B19R0.149 CCCCCCCCCCC\C=C\CCCCC(O)=O Amb22732392 [0,2,0,0,0,0|0,0,2]=4 148 B19R0.149 CCCCCCCCCC\C=C\CCCCOC(C)=O Amb22740021 [0,2,0,0,0,0|2,0,0]=4 149 B19R0.149 CCCCCCCCC\C=C/CCCCCCC(O)=O Amb21928953 [0,2,0,0,0,0|0,0,0]=2 150 B19R0.149 CCCCCCCCC\C=C/C\C=C/CCCC(O)=O Amb21928939 [0,2,0,0,0,0|0,0,1]=3 151 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(=O)N Amb17618835 [0,2,0,0,0,0|1,0,0]=3 152 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22337682 [0,2,0,0,0,0|0,0,0]=2 153 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22351280 [0,2,0,0,0,0|0,0,0]=2 154 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22360659 [0,2,0,0,0,0|0,0,0]=2 155 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22432561 [0,2,0,0,0,0|0,0,0]=2 156 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22730958 [0,2,0,0,0,0|0,0,0]=2 157 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22733375 [0,2,0,0,0,0|0,0,0]=2 158 B19R0.149 CCCCCCCC\C=C/CCCCCCCC(O)=O Amb22734450 [0,2,0,0,0,0|0,0,0]=2 159 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb19960036 [0,2,0,0,0,0|0,0,1]=3 160 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb20246443 [0,2,0,0,0,0|0,0,1]=3 161 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb21520391 [0,2,0,0,0,0|0,0,1]=3 162 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22338064 [0,2,0,0,0,0|0,0,1]=3 163 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22349267 [0,2,0,0,0,0|0,0,1]=3 164 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22729194 [0,2,0,0,0,0|0,0,1]=3 165 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22729375 [0,2,0,0,0,0|0,0,1]=3 166 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22729952 [0,2,0,0,0,0|0,0,1]=3 167 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22730357 [0,2,0,0,0,0|0,0,1]=3 168 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22730716 [0,2,0,0,0,0|0,0,1]=3 169 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22731019 [0,2,0,0,0,0|0,0,1]=3 170 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22733452 [0,2,0,0,0,0|0,0,1]=3 171 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22733454 [0,2,0,0,0,0|0,0,1]=3 172 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22734062 [0,2,0,0,0,0|0,0,1]=3 173 B19R0.149 CCCCCCCC\C=C/CCCCCCCC([O-])=O Amb22734215 [0,2,0,0,0,0|0,0,1]=3 174 B19R0.149 CCCCCCCC\C=C/CCCCCCC[13C](=O)O Amb17618858 [0,2,0,0,0,0|0,0,0]=2 175 B19R0.149 CCCCCCCC\C=C/CCCCCCOC(C)=O Amb22740020 [0,2,0,0,0,0|1,0,0]=3 176 B19R0.149 CCCCCCCC\C=C/C\C=C/CCCCC(O)=O Amb21928932 [0,2,0,0,0,0|0,0,0]=2 177 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(=O)Cl Amb20001478 [0,2,0,0,0,0|1,0,0]=3 178 B19R0.149 CCCCCCCC\C=C\CCCCCCCC(O)=O Amb22369201 [0,2,0,0,0,0|0,0,0]=2 179 B19R0.149 CCCCCCCC\[13CH]=[13CH]/CCCCCCC[13C](O)=O Amb22353961 [0,2,0,0,0,0|0,0,0]=2 180 B19R0.149 CCCCCCCC\[13CH]=[13CH]/[13CH2][13CH2]CCC[13CH2][13CH2][13C](O)=O Amb22353878 [0,2,0,0,0,0|0,0,0]=2 181 B19R0.149 CCCCCCC\C=C\C=C\CCCCCCC(O)=O Amb21928936 [0,2,0,0,0,0|0,0,1]=3 182 B19R0.149 CCCCCCC\C=C\CCCCCCCCC(O)=O Amb22040077 [0,2,0,0,0,0|0,0,2]=4 183 B19R0.149 CCCCCC\C=C/C=C\CCCCCCCC(O)=O Amb21928933 [0,2,0,0,0,0|0,0,2]=4 184 B19R0.149 CCCCCC\C=C\C=C/CCCCCCCC(O)=O Amb21928935 [0,2,0,0,0,0|0,0,2]=4 185 B19R0.149 CCCCCC\C=C\C=C\CCCCCCCC(O)=O Amb21928938 [0,2,0,0,0,0|0,0,2]=4 186 B19R0.149 CCCCCC\C=C\CCCCCCCCC[13C](O)=O Amb22338962 [0,2,0,0,0,0|0,0,2]=4 187 B19R0.149 CCCCC\C=C/C\C=C/CC\C=C\CCCC(O)=O Amb21928948 [0,2,0,0,0,0|0,0,2]=4 188 B19R0.149 CCCCC\C=C\C\C=C\CCCCCCCC(O)=O Amb22359883 [0,2,0,0,0,0|0,0,2]=4 189 B19R0.149 CCCC\C=C\CCCCCCCCCCCC(O)=O Amb22348161 [0,2,0,0,0,0|0,0,2]=4 190 B19R0.149 ICCCCCCCCCCCCCCCCC(=O)O Amb10071542 [0,2,0,0,0,0|0,0,2]=4 191 B19R0.149 OC(=O)CCCCCCCCCCCCCCCCBr Amb19887564 [0,2,0,0,0,0|0,0,2]=4 192 B19R0.149 [13CH3]C[13CH2]C[13CH2]C[13CH2]C\[13CH]=C/[13CH2]C[13CH2]C[13CH2]C[13CH2]C([O-])=O Amb22367644 [0,2,0,0,0,0|0,0,1]=3 193 B19R0.149 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13C](O)=O Amb22353668 [0,2,0,0,0,0|0,0,2]=4 194 B19R0.149 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2]\[13CH]=[13CH]/[13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2]C(O)=O Amb21928779 [0,2,0,0,0,0|0,0,0]=2 195 B19R0.149 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2]\[13CH]=[13CH]/[13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13CH2][13C](O)=O Amb22366940 [0,2,0,0,0,0|0,0,0]=2 196 B19R0.443 CC(C)CCCCCCCCCCCCCCC(O)=O Amb21928808 [0,2,0,0,0,0|0,0,2]=4 197 B19R0.443 CC(CCCCCCCCCCCCCCC(=O)O)Br Amb10071513 [0,2,0,0,0,0|0,0,2]=4 198 B19R0.450 CC(O)CCCCCCCCCCCC(O)CC(O)=O Amb24326319 [0,2,0,0,0,0|0,0,2]=4 199 B17R1.11298 O=C1CCCCCCCCCCCCCCC1 Amb23453288 [1,0,0,1,0,0|1,0,1]=4 200 B17R1.444 CC1CCCCCCCCCCCCCC1=O Amb22641509 [1,0,0,1,0,0|0,0,2]=4 201 B17R1.1450 CCCCCCCCCCC1CCCCC1=O Amb23496208 [1,0,0,1,0,0|0,0,2]=4 202 B19R1.8151 CCCCCCCCC(=O)N1CCOCC1C(O)=O Amb24005075 [0,1,0,1,0,0|2,0,0]=4 203 B19R1.25728 OC(=O)CCCCCNC(=O)CCC1CCOCC1 Amb25512987 [0,1,0,1,0,0|2,0,0]=4 204 B19R1.49085 OC(=O)CCCCCNC(=O)CCCC1CCCC1 Amb25512877 [0,1,0,1,0,0|1,0,0]=3 205 B19R1.46541 CCCCCCC1CC1CCCCCCCC(O)=O Amb22731768 [0,1,0,1,0,0|0,0,2]=4 206 B19R1.274 CCCCCCCCCCCCC[C@@H]1CCC(=O)O1 Amb24309496 [0,1,0,1,0,0|0,0,2]=4 207 B19R1.49447 OC(=O)CCCNC1CCCCCCCCCCC1 Amb23918289 [0,1,0,1,0,0|0,0,2]=4 208 B19R1.15976 CCCCCCCCCN1CC(CC(O)=O)CCC1 Amb23952455 [0,1,0,1,0,0|1,0,1]=4 209 B19R1.48098 CC(CCCCCCC)NCC1CCCC1C(O)=O Amb24013728 [0,1,0,1,0,0|1,0,1]=4 210 B19R1.25747 OC(=O)CCCCNC(=O)CCCC1CCCCC1 Amb24814493 [0,1,0,1,0,0|1,0,1]=4 211 B19R2.8826 OC(=O)C1CCCCN1CCCC2CCCCC2 Amb25617529 [0,0,0,2,0,0|1,0,1]=4 212 B19R2.113084 OC(=O)C1CCCCN1CCC2CCCCCC2 Amb25617463 [0,0,0,2,0,0|1,0,1]=4