0 B9R1.7 CCC[C@H]1COC(=O)C1 YH66390 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.7 CCOC1C=CC(=O)O1 YH51815 [0,0,0,0,0,0|1,0,2]=3 2 B9R1.7 CCOC1CCC(=O)N1 YH59072 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.1 C=CC1CCC(=O)N1 RT14258 [1,0,0,0,0,0|1,0,2]=4 4 B8R1.1 C=CC1CCC(=O)O1 LT3251 [1,0,0,0,0,0|0,0,2]=3 5 B8R1.1 C=CC1COC(=O)O1 XJ2668 [1,0,0,0,0,0|1,0,2]=4 6 B8R1.1 CC1CCC(CO)O1 RT14154 [1,0,0,0,0,0|2,0,1]=4 7 B8R1.1 NCC1CNC(=O)O1 RT4366 [1,0,0,0,0,0|2,0,0]=3 8 B8R1.1 NCC1COC(=O)N1 RT4368 [1,0,0,0,0,0|3,0,0]=4 9 B8R1.1 O=C1C=C[C@H](CO)O1 LL1404 [1,0,0,0,0,0|1,0,2]=4 10 B8R1.1 O=C1CC[C@@H](CO)N1 RT15015 [1,0,0,0,0,0|2,0,0]=3 11 B8R1.1 O=C1CC[C@H](CO)N1 RT14231 [1,0,0,0,0,0|2,0,0]=3 12 B8R1.8 BrCCC1OCCO1 LQ4089 [1,0,0,0,0,0|2,0,1]=4 13 B8R1.8 CCOC1CCCO1 XJ3908 [1,0,0,0,0,0|1,0,1]=3 14 B8R1.8 NCCC1OCCO1 XJ2993 [1,0,0,0,0,0|2,0,1]=4 15 B8R1.8 O=CCC1CCCO1 RT17487 [1,0,0,0,0,0|1,0,2]=4 16 B8R1.8 OCCC1CCNC1 YH96359 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.14 COC(=O)C1CCC(=O)C1 YH54630 [0,1,0,0,0,0|2,0,1]=4 18 B10R1.14 COC(=O)[C@@H]1CCC(=O)N1 XJ2802 [0,1,0,0,0,0|2,0,1]=4 19 B10R1.54 CC(C)CC1CNC(=O)C1 RT14639 [0,1,0,0,0,0|2,0,0]=3 20 B10R1.54 CC(C)CC1OCC(C)O1 XJ4462 [0,1,0,0,0,0|2,0,1]=4 21 B10R1.54 O=C(O)CC1CCC(=O)C1 YH50499 [0,1,0,0,0,0|2,0,1]=4 22 B8R0.5 CCCC(O)CC(=O)O RT0532 [0,0,1,0,0,0|3,0,0]=4 23 B8R0.5 COCC(C)OC(C)=O LQ0411 [0,0,1,0,0,0|1,0,0]=2 24 B8R0.6 C=CC(=O)OCCCC XJ0575 [0,0,1,0,0,0|0,0,2]=3 25 B8R0.6 CCCCCC(=O)CC HL1322 [0,0,1,0,0,0|1,0,0]=2 26 B8R0.6 CCCCCC(=O)OC HL1324 [0,0,1,0,0,0|2,0,0]=3 27 B8R0.6 CCCCCC(O)CC HL0071 [0,0,1,0,0,0|1,0,2]=4 28 B8R0.6 CCCCOC(=O)C=O LQ3022 [0,0,1,0,0,0|1,0,1]=3 29 B8R0.6 CCCCOC(=O)CCl HL0074 [0,0,1,0,0,0|1,0,0]=2 30 B8R0.6 CCCCOC(=O)CO LT4349 [0,0,1,0,0,0|1,0,0]=2 31 B8R0.6 CCC\C=C\C(=O)OC JZ1988 [0,0,1,0,0,0|2,0,1]=4 32 B8R0.6 CCO\C=C\C(=O)CC RT16428 [0,0,1,0,0,0|2,0,1]=4 33 B8R0.6 COC(=O)CCCCCl XJ4043 [0,0,1,0,0,0|3,0,0]=4 34 B8R0.6 COC(=O)CCCCO RT18638 [0,0,1,0,0,0|3,0,0]=4 35 B8R0.7 C=CCCCCC(=O)O XJ1588 [0,0,1,0,0,0|0,0,2]=3 36 B8R0.7 CC(=O)OCCCCCl LT2385 [0,0,1,0,0,0|3,0,0]=4 37 B8R0.7 CC(=O)OCCCCI LQ5055 [0,0,1,0,0,0|3,0,0]=4 38 B8R0.7 CCCCCCC(=O)O XJ0376 [0,0,1,0,0,0|0,0,0]=1 39 B8R0.7 CCCCCCC(C)Br LQ1034 [0,0,1,0,0,0|2,0,1]=4 40 B8R0.7 CCCCCCC(C)N LQ1330 [0,0,1,0,0,0|2,0,1]=4 41 B8R0.7 CCCCCCC(C)O XJ2646 [0,0,1,0,0,0|1,0,1]=3 42 B8R0.7 CCCCCCC(C)O XJ2647 [0,0,1,0,0,0|1,0,1]=3 43 B8R0.7 CCCCCCC(C)S XJ2345 [0,0,1,0,0,0|1,1,1]=4 44 B8R0.7 CCCCCCN(C)C JZ2511 [0,0,1,0,0,0|3,0,0]=4 45 B8R0.7 CCCCCC[C@H](C)O XJ6892 [0,0,1,0,0,0|1,0,1]=3 46 B8R0.7 CCCCCC[N+](=O)[O-] RT0284 [0,0,1,0,0,0|1,0,1]=3 47 B8R0.7 CCCCCOC(=S)[S-] XJ2277 [0,0,1,0,0,0|1,2,0]=4 48 B8R0.7 CCCCCOC(C)=O HL0284 [0,0,1,0,0,0|2,0,0]=3 49 B8R0.7 CCCCOCC(=O)O HL2310 [0,0,1,0,0,0|1,0,0]=2 50 B8R0.7 CCCCOCC(C)O JZ5031 [0,0,1,0,0,0|2,0,1]=4 51 B8R0.7 CCCC\C=C\C(C)=O XJ4452 [0,0,1,0,0,0|1,0,2]=4 52 B8R0.7 CCOCCOC(=O)Cl JZ0072 [0,0,1,0,0,0|3,0,0]=4 53 B8R0.7 CSCCCOC(C)=O LQ3932 [0,0,1,0,0,0|3,0,0]=4 54 B8R0.7 N#CCCCCC(N)=O RT4815 [0,0,1,0,0,0|2,0,1]=4 55 B8R0.7 NCCCCCC(=O)O JZ1196 [0,0,1,0,0,0|1,0,0]=2 56 B8R0.7 NCCCCCC(=O)O RT0574 [0,0,1,0,0,0|1,0,0]=2 57 B8R0.7 NCCC\C=C\C(=O)O RT5552 [0,0,1,0,0,0|1,0,2]=4 58 B8R0.7 O=C(Cl)CCCCCCl XJ4464 [0,0,1,0,0,0|2,0,0]=3 59 B8R0.7 O=C(O)CCCCCBr HL2738 [0,0,1,0,0,0|1,0,0]=2 60 B8R0.7 O=C(O)CCCCCCl LT3590 [0,0,1,0,0,0|1,0,0]=2 61 B8R0.7 O=C(O)CCCCCO JZ4450 [0,0,1,0,0,0|1,0,0]=2 62 B10R1.1 C=CCC1C=CC(=O)CC1 RT16420 [0,0,0,0,0,1|1,0,2]=4 63 B10R1.1 CCCC1CCC(=O)CC1 LQ5064 [0,0,0,0,0,1|1,0,0]=2 64 B10R1.1 CCCN1CCC(=O)CC1 LQ4369 [0,0,0,0,0,1|2,0,0]=3 65 B10R1.10 CCCC1CCCC(=O)O1 LQ1386 [0,0,0,0,0,1|0,0,0]=1 66 B10R1.10 O=C1CN(CCO)CCN1 LX3081 [0,0,0,0,0,1|3,0,0]=4 67 B7R0.1 C#CCCCCCC LQ1243 [1,0,1,0,0,0|1,0,1]=4 68 B7R0.1 CCCCCCC#N LQ1245 [1,0,1,0,0,0|1,0,1]=4 69 B7R0.1 CCCCCCCC XJ0405 [1,0,1,0,0,0|1,0,1]=4 70 B7R0.1 CCCCCCCCl LQ1244 [1,0,1,0,0,0|1,0,1]=4 71 B7R0.1 CCCCCCCN XJ0408 [1,0,1,0,0,0|1,0,1]=4 72 B7R0.1 CCCCCCCS HL0937 [1,0,1,0,0,0|0,1,1]=4 73 B7R0.1 CCCCCC[Mg]Cl LQ5137 [1,0,1,0,0,0|2,0,0]=4 74 B7R0.1 CCCCCN=C=O JZ2397 [1,0,1,0,0,0|1,0,1]=4 75 B7R0.1 CCCCCNCC JZ5218 [1,0,1,0,0,0|2,0,0]=4 76 B7R0.1 CCCCCON=O LQ0831 [1,0,1,0,0,0|2,0,0]=4 77 B7R0.1 CCCCNCCC LQ4205 [1,0,1,0,0,0|1,0,1]=4 78 B7R0.1 CCCCOCCO XJ0413 [1,0,1,0,0,0|1,0,1]=4 79 B7R0.1 CCOCCCCO LT2386 [1,0,1,0,0,0|1,0,1]=4 80 B7R0.1 CC\C=C/CCCO XJ3057 [1,0,1,0,0,0|2,0,0]=4 81 B7R0.1 C\C=C\CCCCC XJ0407 [1,0,1,0,0,0|1,0,1]=4 82 B7R0.1 OCCCCCCCl LT3732 [1,0,1,0,0,0|1,0,1]=4 83 B7R0.1 OCCCCCCS HL0924 [1,0,1,0,0,0|1,0,1]=4 84 B7R0.3 C#CCOC(=O)CC LQ2026 [1,0,1,0,0,0|0,0,2]=4 85 B7R0.3 C=CCC[C@H](O)CCl YH66482 [1,0,1,0,0,0|2,0,0]=4 86 B7R0.3 CCCCC(=O)CC XJ0362 [1,0,1,0,0,0|0,0,0]=2 87 B7R0.3 CCCCC(=O)NC HL3084 [1,0,1,0,0,0|1,0,0]=3 88 B7R0.3 CCCCC(=O)NN LQ4942 [1,0,1,0,0,0|2,0,0]=4 89 B7R0.3 CCCCC(C)CC HL0067 [1,0,1,0,0,0|1,0,1]=4 90 B7R0.3 CCCOC(=O)CCl HL2914 [1,0,1,0,0,0|1,0,0]=3 91 B7R0.3 CCCOC(=O)CN LQ3564 [1,0,1,0,0,0|1,0,0]=3 92 B7R0.3 CCOCC(=O)OC RT17745 [1,0,1,0,0,0|2,0,0]=4 93 B7R0.3 COC(=O)CCCCl LT5164 [1,0,1,0,0,0|2,0,0]=4 94 B7R0.3 COC(=O)CCCO RT0271 [1,0,1,0,0,0|2,0,0]=4 95 B7R0.3 COC(=O)CCSC LQ3661 [1,0,1,0,0,0|2,0,0]=4 96 B7R0.3 COCCC(=O)OC LQ2522 [1,0,1,0,0,0|2,0,0]=4 97 B7R0.7 C=CCC(O)CCC JZ2295 [1,0,1,0,0,0|0,0,1]=3 98 B7R0.7 CCCC(Br)CCC HL0633 [1,0,1,0,0,0|1,0,1]=4 99 B7R0.7 C\C=C\C(O)CCC JZ2612 [1,0,1,0,0,0|1,0,1]=4 100 B7R0.2 CCC(C)NC(N)=O JZ0727 [1,0,1,0,0,0|2,0,0]=4 101 B7R0.2 CCC(C)OC(=O)Cl YH40190 [1,0,1,0,0,0|1,0,0]=3 102 B7R0.2 CC[C@H](C)CC(=O)O LX2881 [1,0,1,0,0,0|2,0,0]=4 103 B7R0.2 CC[C@H](C)CC(=O)O YH39271 [1,0,1,0,0,0|2,0,0]=4 104 B7R0.4 CC(=O)SCCCBr RT1374 [1,0,1,0,0,0|1,1,0]=4 105 B7R0.4 CCCCCC(N)=O HL0268 [1,0,1,0,0,0|1,0,0]=3 106 B7R0.4 CCCCC[C@H](C)O JZ2825 [1,0,1,0,0,0|1,0,1]=4 107 B7R0.4 CCCCOC(=S)[S-] XJ1408 [1,0,1,0,0,0|1,1,0]=4 108 B7R0.4 CCCCOC(C)=O HL1469 [1,0,1,0,0,0|0,0,0]=2 109 B7R0.4 CCCCOC(N)=O LT4346 [1,0,1,0,0,0|1,0,0]=3 110 B7R0.4 CCCCO[N+](=O)[O-] RT17647 [1,0,1,0,0,0|2,0,0]=4 111 B7R0.4 CCCCSC(C)=O LQ1519 [1,0,1,0,0,0|0,1,0]=3 112 B7R0.4 CCC\C=C\C(=O)O JZ4447 [1,0,1,0,0,0|0,0,2]=4 113 B7R0.4 CCC\C=C\C(C)=O XJ1585 [1,0,1,0,0,0|1,0,1]=4 114 B7R0.4 CNCCCC(=O)O RT0333 [1,0,1,0,0,0|1,0,0]=3 115 B7R0.4 COCCOC(=O)Cl HL0272 [1,0,1,0,0,0|2,0,0]=4 116 B7R0.4 O=C(Cl)CCCCBr HL2752 [1,0,1,0,0,0|2,0,0]=4 117 B7R0.4 O=C(Cl)CCCCCl LT3549 [1,0,1,0,0,0|2,0,0]=4 118 B7R0.4 O=C(Cl)OCCCCl LT2580 [1,0,1,0,0,0|2,0,0]=4 119 B7R0.4 O=C(O)CCCCBr JZ0370 [1,0,1,0,0,0|1,0,0]=3 120 B7R0.4 O=C(O)CNCCO RT16423 [1,0,1,0,0,0|2,0,0]=4 121 B7R0.4 O=C([O-])CCCCBr LT3131 [1,0,1,0,0,0|1,0,1]=4 122 B7R0.4 O=C([O-])CCCCO YH65793 [1,0,1,0,0,0|1,0,1]=4 123 B7R0.12 CCCN(CC)N=O RT17895 [1,0,1,0,0,0|2,0,0]=4 124 B7R1.1 BrCC1CCCO1 JZ4457 [2,0,0,0,0,0|1,0,1]=4 125 B7R1.1 OCC1CCCO1 YH98620 [2,0,0,0,0,0|1,0,1]=4 126 B7R1.2 CC1=CC(=O)CC1 HL2331 [2,0,0,0,0,0|1,0,1]=4 127 B7R1.2 CC1=CCC(=O)O1 HL0093 [2,0,0,0,0,0|0,0,2]=4 128 B7R1.2 CC1CCC(=O)C1 XJ1883 [2,0,0,0,0,0|1,0,0]=3 129 B7R1.2 CC1CCC(C)O1 HL0575 [2,0,0,0,0,0|1,0,1]=4 130 B7R1.2 CC1CSC(=O)S1 RT14660 [2,0,0,0,0,0|1,1,0]=4 131 B7R1.2 CN1CCC(=O)C1 XJ6122 [2,0,0,0,0,0|2,0,0]=4 132 B7R1.2 C[C@H]1COC(=O)N1 YH59595 [2,0,0,0,0,0|2,0,0]=4 133 B7R1.2 O=C1CCC(=O)O1 JZ0987 [2,0,0,0,0,0|1,0,1]=4 134 B7R1.2 O=C1OCC(Cl)O1 LT4482 [2,0,0,0,0,0|2,0,0]=4 135 B7R1.2 O=C1OCC(Cl)O1 LT7595 [2,0,0,0,0,0|2,0,0]=4 136 B9R0.5 CCCCCC(O)CCC LQ2960 [0,1,1,0,0,0|1,0,1]=4 137 B9R0.48 CCCC(C)CCC(C)=O LQ5431 [0,1,1,0,0,0|1,0,0]=3 138 B9R0.66 CCCCC(C)(O)CCC JZ5568 [0,1,1,0,0,0|1,0,1]=4 139 B9R0.1 CCC(=O)OCCC(C)C XJ0333 [0,1,1,0,0,0|0,0,0]=2 140 B9R0.24 CCC(=O)CCC(=O)CC RT0042 [0,1,1,0,0,0|1,0,1]=4 141 B9R0.46 CCCCCCC(=O)CC LQ1506 [0,1,1,0,0,0|1,0,0]=3 142 B9R0.46 CCCCCCC(=O)NC LQ4481 [0,1,1,0,0,0|2,0,0]=4 143 B9R0.46 CCCCCOC(=O)CC XJ1170 [0,1,1,0,0,0|0,0,0]=2 144 B9R0.47 C=C(C)C(=O)OCCCC LL0291 [0,1,1,0,0,0|0,0,1]=3 145 B9R0.47 CCCCCC(=O)N(C)C HL3038 [0,1,1,0,0,0|2,0,0]=4 146 B9R0.47 CCCCOC(=O)C(C)=O LT5784 [0,1,1,0,0,0|0,0,1]=3 147 B9R0.47 CCCCOC(=O)C(C)C LL0290 [0,1,1,0,0,0|0,0,0]=2 148 B9R0.2 CCCCCC#CC(=O)O XJ2930 [0,1,1,0,0,0|0,0,1]=3 149 B9R0.2 CCCCCCCC(=O)[O-] HL2823 [0,1,1,0,0,0|0,0,1]=3 150 B9R0.2 CCCCCCCC(=O)[O-] HL4498 [0,1,1,0,0,0|0,0,1]=3 151 B9R0.2 CCCCCCCC(=O)[O-] LQ1024 [0,1,1,0,0,0|0,0,1]=3 152 B9R0.2 CCCCCCCC(C)=O LQ1471 [0,1,1,0,0,0|1,0,0]=3 153 B9R0.2 CCCCCCCC(C)O LQ1241 [0,1,1,0,0,0|1,0,1]=4 154 B9R0.2 NCCSSCCC(=O)O RT4042 [0,1,1,0,0,0|2,0,0]=4 155 B9R0.2 O=C(O)CCCCCCBr YH53191 [0,1,1,0,0,0|0,0,0]=2 156 B9R0.2 O=C(O)CCCCCCO RT17679 [0,1,1,0,0,0|0,0,0]=2 157 B9R0.2 O=C(O)CCSSCCO RT19778 [0,1,1,0,0,0|2,0,0]=4 158 B9R0.38 CCCCCCP(=O)(O)O LQ2762 [0,1,1,0,0,0|1,0,0]=3 159 B9R0.38 CCCCCCS(=O)(=O)[O-] HL2404 [0,1,1,0,0,0|1,0,1]=4 160 B9R0.55 CC(=O)NCCCC(=O)O XJ2382 [0,1,1,0,0,0|1,0,1]=4 161 B9R0.55 CC(C)CCCCC(=O)[O-] LL1076 [0,1,1,0,0,0|0,0,1]=3 162 B9R0.55 CC(C)CCCCC(=O)[O-] XJ6478 [0,1,1,0,0,0|0,0,1]=3 163 B9R0.55 O=C(O)CCCCC(=O)O LQ4458 [0,1,1,0,0,0|1,0,1]=4 164 B9R0.55 O=C(O)CCCCC(=O)O RT17669 [0,1,1,0,0,0|1,0,1]=4 165 B9R0.17 CCCC(OCC)OCC LT4359 [0,1,1,0,0,0|1,0,1]=4 166 B9R1.35 O=C1CC[C@H](C(=O)O)O1 YH05861 [1,1,0,0,0,0|1,0,1]=4 167 B9R1.35 O=C1CC[C@H](C(=O)O)O1 YH46331 [1,1,0,0,0,0|1,0,1]=4 168 B9R1.12 ClCCCC1OCCO1 LT0212 [1,1,0,0,0,0|1,0,1]=4 169 B9R1.12 OCCCC1CCCO1 RT15043 [1,1,0,0,0,0|0,0,1]=3 170 B9R1.33 CCOC1OC=NC1C LT3856 [1,1,0,0,0,0|2,0,0]=4 171 B9R1.134 CNCC1(C)CCCO1 RT4249 [1,1,0,0,0,0|1,0,1]=4 172 B11R1.20 CC(C)OC1CCC(=O)CO1 RT15437 [0,1,0,0,0,1|1,0,0]=3 173 B11R1.24 CCCCC1CCCC(=O)O1 XJ2453 [0,1,0,0,0,1|0,0,0]=2 174 B11R1.24 CCCCC1CCCC(=O)O1 XJ6789 [0,1,0,0,0,1|0,0,0]=2 175 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 YH15335 [0,2,0,0,0,0|1,0,1]=4 176 B11R1.15 CCSC(=O)[C@@H]1CCC(=O)N1 RT15580 [0,2,0,0,0,0|1,0,1]=4 177 B11R1.230 CCCCC1OC(=O)NC1=O XJ4688 [0,2,0,0,0,0|1,0,1]=4 178 B9R1.49 CN1CCCC(=O)CC1 CJ2109 [0,0,1,1,0,0|2,0,0]=4 179 B9R1.50 OC1CCCCCCC1 LQ1369 [0,0,1,1,0,0|1,0,1]=4 180 B9R1.69 CC1CN(C)CCC1=O YH02404 [0,0,1,1,0,0|2,0,0]=4 181 B9R1.34 CC1=CC(=O)CC(C)C1 HL0663 [0,0,1,1,0,0|1,0,1]=4 182 B9R1.1 CCN1CCC(=O)CC1 XJ2485 [0,0,1,1,0,0|2,0,0]=4 183 B9R1.5 NC1CCCCNC1=O YH41189 [0,0,1,1,0,0|2,0,0]=4 184 B9R1.5 N[C@H]1CCCCNC1=O JZ0849 [0,0,1,1,0,0|2,0,0]=4 185 B9R1.6 CC(=O)C1CCCCN1 YH98487 [0,0,1,1,0,0|2,0,0]=4 186 B9R1.6 CC(=O)C1CCOCC1 YH65687 [0,0,1,1,0,0|2,0,0]=4 187 B9R1.6 CC(=O)N1CCCCC1 LQ3683 [0,0,1,1,0,0|2,0,0]=4 188 B9R1.6 NC(=O)C1CCCNC1 YH00565 [0,0,1,1,0,0|2,0,0]=4 189 B9R1.6 NC(=O)C1CCNCC1 RT4533 [0,0,1,1,0,0|2,0,0]=4 190 B9R1.6 O=C(Cl)C1CCCCC1 XJ2272 [0,0,1,1,0,0|1,0,0]=3 191 B9R1.6 O=C(Cl)C1CCOCC1 LQ4996 [0,0,1,1,0,0|2,0,0]=4 192 B9R1.6 O=C(O)C1=CCCCC1 JZ4029 [0,0,1,1,0,0|0,0,2]=4 193 B9R1.6 O=C(O)C1CC=CCC1 JZ4561 [0,0,1,1,0,0|0,0,2]=4 194 B9R1.6 O=C(O)C1CC=CCC1 SY0237 [0,0,1,1,0,0|0,0,2]=4 195 B9R1.6 O=C(O)C1CCCCN1 LT0384 [0,0,1,1,0,0|1,0,0]=3 196 B9R1.6 O=C(O)C1CCCNC1 LT2969 [0,0,1,1,0,0|1,0,0]=3 197 B9R1.6 O=C(O)C1CCNCC1 LT3745 [0,0,1,1,0,0|1,0,0]=3 198 B9R1.6 O=C(O)C1CCOCC1 XJ2848 [0,0,1,1,0,0|1,0,0]=3 199 B9R1.6 O=C(O)C1CNCCN1 HL2333 [0,0,1,1,0,0|2,0,0]=4 200 B9R1.6 O=C(O)C1CNCCN1 YH52942 [0,0,1,1,0,0|2,0,0]=4 201 B9R1.6 O=C(O)C1CNCCO1 YH52809 [0,0,1,1,0,0|2,0,0]=4 202 B9R1.6 O=C(O)C1COCCN1 HL4648 [0,0,1,1,0,0|2,0,0]=4 203 B9R1.6 O=C(O)N1CCCCC1 RT9921 [0,0,1,1,0,0|1,0,0]=3 204 B9R1.6 O=C(O)[C@@H]1CC=CCC1 YH07763 [0,0,1,1,0,0|0,0,2]=4 205 B9R1.6 O=C(O)[C@@H]1CCCNC1 YH49486 [0,0,1,1,0,0|1,0,0]=3 206 B9R1.6 O=C(O)[C@@H]1CNCCN1 HL3574 [0,0,1,1,0,0|2,0,0]=4 207 B9R1.6 O=C(O)[C@@H]1CNCCN1 YH37461 [0,0,1,1,0,0|2,0,0]=4 208 B9R1.6 O=C(O)[C@@H]1COCCN1 LX3021 [0,0,1,1,0,0|2,0,0]=4 209 B9R1.6 O=C(O)[C@H]1CCCCN1 JZ0473 [0,0,1,1,0,0|1,0,0]=3 210 B9R1.6 O=C(O)[C@H]1CCCCN1 LX2188 [0,0,1,1,0,0|1,0,0]=3 211 B9R1.6 O=C(O)[C@H]1CCCNC1 YH08791 [0,0,1,1,0,0|1,0,0]=3 212 B9R1.6 O=C(O)[C@H]1CCCNC1 YH89771 [0,0,1,1,0,0|1,0,0]=3 213 B9R1.6 O=C(O)[C@H]1CNCCN1 LQ4703 [0,0,1,1,0,0|2,0,0]=4 214 B9R1.6 OB(O)C1CCCCC1 XJ2694 [0,0,1,1,0,0|1,0,1]=4 215 B9R1.83 CCCCCCC1CO1 XJ2325 [0,0,1,1,0,0|1,0,1]=4 216 B9R1.85 O=C(O)COCC1CC1 RT17500 [0,0,1,1,0,0|1,0,0]=3 217 B9R1.148 CC1(O)CCCCCC1 HL2619 [0,0,1,1,0,0|1,0,1]=4 218 B9R2.3 C1CC2CNCC2C1 XJ6850 [1,0,0,1,0,0|2,0,0]=4 219 B9R2.3 [C@H]12CCC[C@H]1C=NC2 YH66610 [1,0,0,1,0,0|2,0,0]=4 220 B11R2.34 O=C1CCN(C2CC2)CC1 XJ5990 [0,0,0,1,0,1|2,0,0]=4 221 B11R2.352 O=C1CC(C2CCC2)CN1 LX2158 [0,1,0,1,0,0|2,0,0]=4 222 B11R2.15 O=NN1CC2CCCC2C1 RT15519 [0,1,0,1,0,0|2,0,0]=4 223 B7R0.5 CCCC(=O)C(C)=O LQ2544 [0,0,1,0,1,0|1,0,1]=4 224 B7R0.5 CCCC(C)C(=O)Cl LQ2858 [0,0,1,0,1,0|1,0,0]=3 225 B7R0.5 CCCC(C)C(=O)O LL0280 [0,0,1,0,1,0|1,0,0]=3 226 B7R0.5 CCC[C@H](C)C(=O)O RT0270 [0,0,1,0,1,0|1,0,0]=3 227 B7R0.5 CCC[C@H](N)C(=O)O LT7574 [0,0,1,0,1,0|2,0,0]=4 228 B7R0.5 CSCC(C)C(=O)O RT5786 [0,0,1,0,1,0|2,0,0]=4 229 B7R1.10 COC1CC(=O)C1 YH53549 [1,0,0,0,1,0|2,0,0]=4