0 B11R2.533 [C@H]12C[C@H](C1(C)C)CCC2=O R229253 [0,0,0,0,0,0|1,0,1]=2 1 B12R2.766 C[C@H]1CC(=O)C2CC1C2(C)C T258598 [0,1,0,0,0,0|1,0,1]=3 2 B12R2.1957 C=CC1=CCC2CC1C2(C)C T245763 [0,1,0,0,0,0|0,0,1]=2 3 B12R2.1957 CC1(C2CC=C(C1C2)CBr)C T248487 [0,1,0,0,0,0|0,0,0]=1 4 B12R2.1957 CC1(C2CCC(C1C2)CO)C S455504 [0,1,0,0,0,0|0,0,2]=3 5 B12R2.2863 C=C1C(=O)CC2CC1C2(C)C T272655 [0,1,0,0,0,0|0,0,1]=2 6 B12R2.2863 CC1(C2CC(C(=O)C1C2)Br)C T248517 [0,1,0,0,0,0|1,0,1]=3 7 B10R1.13 CC(C)N1CCC(=O)CC1 S563617 [0,0,1,0,0,0|2,0,1]=4 8 B10R1.13 CC(C)[C@@H]1CCC(=O)OC1 T295736 [0,0,1,0,0,0|2,0,0]=3 9 B10R1.13 CC1CCC(CC1)C(C)O PH000605 [0,0,1,0,0,0|1,0,2]=4 10 B10R1.61 CC(C)N1CCCNC1=O PH009682 [0,0,1,0,0,0|3,0,0]=4 11 B10R1.61 CC1=CCCCC1C(C)O T180114 [0,0,1,0,0,0|1,0,0]=2 12 B12R2.1088 C=C1C=CCC2CC1C2(C)C T213179 [0,0,0,0,0,1|0,0,1]=2 13 B12R2.1088 CC1(C2CCCC(=O)C1C2)C T213063 [0,0,0,0,0,1|1,0,1]=3 14 B9R1.1 COC1CC=C(CC1)C T196010 [1,0,1,0,0,0|1,0,0]=3 15 B9R1.1 N1CC(CCC1C)CC S361844 [1,0,1,0,0,0|1,0,1]=4 16 B9R1.6 CC(C)C1CCCCN1 PH003734 [1,0,1,0,0,0|1,0,1]=4 17 B9R1.6 CC(C)C1CCNCC1 CDS000108 [1,0,1,0,0,0|1,0,1]=4 18 B9R1.6 CC(O)C1C=CCCC1 T181412 [1,0,1,0,0,0|1,0,0]=3 19 B9R1.15 COC1CCCC=C1Br T261521 [1,0,1,0,0,0|2,0,0]=4 20 B9R1.40 CC1(CCC=CC1=O)C T203114 [1,0,1,0,0,0|1,0,1]=4 21 B9R1.3 CC1=CCCC(C1=O)C T297577 [1,0,1,0,0,0|1,0,1]=4 22 B9R1.3 CC1CCCC(=O)C1C CDS023514 [1,0,1,0,0,0|1,0,1]=4 23 B11R1.3 COC1=CCC(=CC1)C(C)C T209813 [0,1,1,0,0,0|0,0,2]=4 24 B11R1.21 CC1CC(C=CC1=O)C(C)C T209848 [0,1,1,0,0,0|1,0,1]=4 25 B11R1.21 CC1CC[C@H](CC1=O)C(C)C T218626 [0,1,1,0,0,0|0,0,1]=3 26 B11R1.22 [C@@H]1(CC=C(CC1)C)[C@@H](C)CO PH011482 [0,1,1,0,0,0|0,0,0]=2 27 B11R1.166 CC(C)[C@@H]1CC[C@H](C[C@H]1N)C PH015551 [0,1,1,0,0,0|0,0,2]=4 28 B11R1.87 CC(C)(C)C1CCCCC1=O S576697 [0,1,1,0,0,0|1,0,1]=4 29 B11R1.222 COC(C)C1CCCC=C1C T183830 [0,1,1,0,0,0|0,0,0]=2 30 B11R1.424 CC1=CCCC(C1C=O)(C)C CDS005151 [0,1,1,0,0,0|0,0,1]=3 31 B13R2.13052 CC1(C2CC=C(C(=O)C1C2)Br)C T213225 [0,1,0,0,0,1|1,0,0]=3 32 B13R2.13052 CC1(C2CC=C([C@H](C1C2)O)Br)C T213144 [0,1,0,0,0,1|1,0,0]=3 33 B13R2.13052 CC1=CCC2CC(C1=O)C2(C)C T213403 [0,1,0,0,0,1|0,0,0]=2 34 B13R2.12104 C1(CC(C2CC1C2(C)C)(C)C)O T282103 [0,2,0,0,0,0|0,0,2]=4 35 B13R2.8511 CC1(C2CCC(C1C2)(O)CO)C T213462 [0,2,0,0,0,0|0,0,2]=4 36 B13R2.6334 CC1C(CC2CC1C2(C)C)CN S457108 [0,2,0,0,0,0|0,0,2]=4 37 B13R2.6334 CC1C(CC2CC1C2(C)C)CN S457884 [0,2,0,0,0,0|0,0,2]=4 38 B9R0.1 CCC(C)CCCC(C)C S765406 [0,0,2,0,0,0|0,0,2]=4 39 B11R2.732 CC1(C2CCC1C(=O)C2)C S461490 [0,0,1,1,0,0|1,0,1]=4 40 B11R2.1506 CC1(C2C=CC=CC1C2)C T213276 [0,0,1,1,0,0|0,0,2]=4 41 B11R2.739 CC1(CC2CC(=O)C1C2)C T245739 [0,0,1,1,0,0|1,0,1]=4 42 B9R1.41 CC(C)C1CCCC1=O CDS023294 [0,0,1,0,1,0|1,0,0]=3 43 B9R1.38 CC1CC(=O)NC1(C)C CBR01605 [0,0,1,0,1,0|2,0,0]=4 44 B9R1.185 CCC(=O)C1CC1(C)C CDS023554 [0,0,1,0,1,0|1,0,1]=4 45 B11R1.565 CC1CCNC(CC1)C(C)C T176184 [0,0,1,0,0,1|0,0,2]=4