0 B10R0.133 CCCC[C@@](N)(CC)C(=O)O 4157-1-SD [0,1,0,0,0,0|2,0,0]=3 1 B10R1.13 CC1=CCC(C(=O)O)CC1 2421-1-10 [0,0,0,1,0,0|2,0,1]=4 2 B10R1.13 C[C@H]1CC[C@H](C(=O)Cl)CC1 2216-5-05 [0,0,0,1,0,0|2,0,0]=3 3 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N 4248-5-00 [0,0,0,1,0,0|2,0,0]=3 4 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O 4257-1-13 [0,0,0,1,0,0|2,0,0]=3 5 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O 4257-5-18 [0,0,0,1,0,0|2,0,0]=3 6 B10R1.61 O=C(O)C1CCCCC1=O 2229-1-0J [0,0,0,1,0,0|1,0,2]=4 7 B10R1.437 COCCC1(C(=O)O)CC1 2221-1-57 [0,0,0,1,0,0|3,0,0]=4 8 B7R0.4 CNCCOC(C)=O 4133-5-03 [2,0,0,0,0,0|2,0,0]=4 9 B7R0.4 O=C(O)CCCCO 2120-1-00 [2,0,0,0,0,0|2,0,0]=4 10 B7R0.5 CC(CCCl)C(=O)Cl 2116-5-21 [2,0,0,0,0,0|2,0,0]=4 11 B7R0.5 CCCC(C)C(C)=O 2117-1-0J [2,0,0,0,0,0|0,0,0]=2 12 B9R0.47 CCCCCC(C)C(C)C 1100-1-08 [1,1,0,0,0,0|1,0,1]=4 13 B9R1.5 N[C@@H]1CCCCC[C@H]1O 4256-1-47 [1,0,0,1,0,0|1,0,1]=4 14 B9R1.6 O=C(Cl)C1CCNCC1 4H16-5-0C [1,0,0,1,0,0|2,0,0]=4 15 B9R1.35 CN1CC[C@H](C(=O)O)C1 4H58-1-ST [1,0,0,1,0,0|2,0,0]=4 16 B9R1.35 C[C@H]1CN[C@H](C(=O)O)C1 4H56-5-W8 [1,0,0,1,0,0|2,0,0]=4 17 B9R1.95 COC1CC(C(=O)O)C1 2221-1-37 [1,0,0,1,0,0|2,0,0]=4 18 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 2221-1-E0 [1,0,0,1,0,0|2,0,0]=4 19 B9R1.95 O=C(O)C1CC(CO)C1 2229-1-88 [1,0,0,1,0,0|2,0,0]=4 20 B9R1.110 N[C@@H](C(=O)O)C1CCC1 4257-1-R4 [1,0,0,1,0,0|2,0,0]=4 21 B9R1.110 N[C@H](C(=O)O)C1CCC1 4257-1-S4 [1,0,0,1,0,0|2,0,0]=4 22 B9R1.112 NC(CC1CC1)C(=O)O 4257-1-26 [1,0,0,1,0,0|2,0,0]=4 23 B9R1.112 N[C@@H](CC1CC1)C(=O)O 4257-1-S7 [1,0,0,1,0,0|2,0,0]=4 24 B9R1.112 N[C@H](CC1CC1)C(=O)O 4257-1-R7 [1,0,0,1,0,0|2,0,0]=4 25 B9R1.112 O=C(O)[C@H](O)CC1CC1 2229-1-R4 [1,0,0,1,0,0|1,0,0]=3 26 B9R1.163 CC1(C(=O)O)CCOC1 2H21-1-91 [1,0,0,1,0,0|2,0,0]=4 27 B9R1.1 CC1CCC(CCl)CC1 1200-6-00 [1,0,0,1,0,0|1,0,1]=4 28 B9R1.15 CN1CCOCC1CO 4H01-1-4E [1,0,0,1,0,0|2,0,0]=4 29 B9R1.15 CN1CCOC[C@@H]1CO 4H01-1-S2 [1,0,0,1,0,0|2,0,0]=4 30 B9R1.15 CN1CCOC[C@H]1CO 4H01-5-R0 [1,0,0,1,0,0|2,0,0]=4 31 B9R1.15 CN[C@@H]1CCCC[C@H]1O 4256-5-37 [1,0,0,1,0,0|1,0,0]=3 32 B9R1.89 OC[C@@H]1CCCCCN1 4H01-1-S6 [1,0,0,1,0,0|1,0,0]=3 33 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O 4257-5-00 [1,0,0,1,0,0|2,0,0]=4 34 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O 4H58-3-1H [1,0,0,1,0,0|2,0,0]=4 35 B9R1.119 NCC1(C(=O)O)CCC1 4257-5-20 [1,0,0,1,0,0|2,0,0]=4 36 B11R1.177 C[C@@]1(N)CCCC[C@@H]1C(=O)O 4258-5-09 [0,1,0,1,0,0|2,0,0]=4 37 B11R1.22 COC(=O)C1CC=C(C)CC1 2423-1-13 [0,1,0,1,0,0|1,0,1]=4 38 B11R1.22 COC(=O)C1CCC(C)NC1 4H23-1-8J [0,1,0,1,0,0|1,0,0]=3 39 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)NC1 4H58-1-UJ [0,1,0,1,0,0|1,0,0]=3 40 B11R1.54 CN[C@@]1(C)CCCC[C@H]1CO 4256-5-28 [0,1,0,1,0,0|1,0,1]=4 41 B11R1.222 COC(=O)C1CCCNC1C 4H23-1-8G [0,1,0,1,0,0|2,0,0]=4 42 B11R1.1472 COC(=O)C1(CN)CCCC1 4230-5-00 [0,1,0,1,0,0|1,0,0]=3 43 B11R1.3 CC(=O)N1CCC(CO)CC1 4H56-1-0GE [0,1,0,1,0,0|2,0,0]=4 44 B11R1.3 COC1CCC(C(=O)Cl)CC1 2216-5-07 [0,1,0,1,0,0|2,0,0]=4 45 B11R1.298 CCC(C(=O)O)N1CCCC1 4H58-1-564 [0,1,0,1,0,0|2,0,0]=4 46 B11R1.298 CC[C@@H](C(=O)O)N1CCCC1 4H58-1-S23 [0,1,0,1,0,0|2,0,0]=4 47 B11R1.298 CC[C@H](C(=O)O)N1CCCC1 4H58-1-R23 [0,1,0,1,0,0|2,0,0]=4 48 B11R1.991 COCCCC1(C(=O)O)CC1 2221-1-56 [0,1,0,1,0,0|2,0,0]=4 49 B11R1.1074 NCC1(C(=O)O)CCOCC1 4H57-5-18 [0,1,0,1,0,0|2,0,0]=4 50 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1N2 4H58-9-64 [0,0,0,2,0,0|2,0,0]=4 51 B11R2.813 O=C(O)C12CNCCC1C2 4H33-5-1R [0,0,0,2,0,0|2,0,0]=4