0 B12R1.3862 CC(=O)OC1(CCCCC1)C#N S431044 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.928 CC(=O)NC1(CCCCC1)C PH011306 [1,0,0,0,0,0|2,0,0]=3 2 B11R1.928 NC1(CCOCC1)CC(=O)O CBR02168 [1,0,0,0,0,0|1,0,0]=2 3 B11R1.928 O=C(O)CC1(CCCCC1)O CDS001976 [1,0,0,0,0,0|1,0,0]=2 4 B13R2.4014 O=C1CC2(CCCCC2)C(=O)N1 T316954 [0,0,0,1,0,0|2,0,1]=4 5 B13R2.11128 O=C1CCCC2(C1)CCCCC2 S757470 [0,0,0,1,0,0|2,0,0]=3 6 B11R1.1074 CCC1(CCCCC1)C(=O)N PH008848 [0,0,0,0,1,0|2,0,0]=3 7 B11R1.1074 CCC1(CCCNC1)C(=O)O CBR02413 [0,0,0,0,1,0|2,0,0]=3 8 B11R1.1074 CCC1(CCNCC1)C(=O)O CBR01341 [0,0,0,0,1,0|2,0,0]=3 9 B11R1.1074 CN(C)C1(CCCCC1)CN CBR00640 [0,0,0,0,1,0|3,0,0]=4 10 B11R1.1074 N#CC1(CCOCC1)C(=O)O CDS009722 [0,0,0,0,1,0|1,0,2]=4 11 B10R1.18 CC(=O)CC1CCCCC1 CDS001548 [2,0,0,0,0,0|1,0,0]=3 12 B10R1.18 CC(=O)CN1CCCCC1 R433675 [2,0,0,0,0,0|2,0,0]=4 13 B10R1.18 CC(=O)NC1CCCCC1 PH004244 [2,0,0,0,0,0|2,0,0]=4 14 B10R1.18 NC(=O)CC1CCCCN1 CDS022187 [2,0,0,0,0,0|2,0,0]=4 15 B10R1.18 NC(=O)CN1CCCCC1 OTV000055 [2,0,0,0,0,0|2,0,0]=4 16 B10R1.18 NC(=O)NC1CCCCC1 S375047 [2,0,0,0,0,0|2,0,0]=4 17 B10R1.18 O=C(O)CC1CCCCN1 R409952 [2,0,0,0,0,0|1,0,0]=3 18 B10R1.18 O=C(O)CC1CCCNC1 PH010234 [2,0,0,0,0,0|1,0,0]=3 19 B10R1.18 O=C(O)CC1CCNCC1 CBR01414 [2,0,0,0,0,0|1,0,0]=3 20 B10R1.18 O=C(O)CC1CCNCC1 CDS007853 [2,0,0,0,0,0|1,0,0]=3 21 B10R1.18 O=C(O)CC1CCNCC1 CDS021798 [2,0,0,0,0,0|1,0,0]=3 22 B10R1.18 O=C(O)CC1CCOCC1 CDS006056 [2,0,0,0,0,0|1,0,0]=3 23 B10R1.18 O=C(O)CN1CCCCC1 CDS005123 [2,0,0,0,0,0|1,0,0]=3 24 B10R1.18 O=C(O)CN1CCCCC1 L481130 [2,0,0,0,0,0|1,0,0]=3 25 B10R1.18 O=C(O)CN1CCOCC1 ANV00112 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.18 O=C(O)CN1CCOCC1 CDS007579 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.18 OB(O)CC1CCCCC1 CDS004056 [2,0,0,0,0,0|1,0,1]=4 28 B10R1.377 C=CCC1(CCCCC1)O S429104 [2,0,0,0,0,0|2,0,0]=4 29 B10R1.487 NCC1(CCOCC1)CO CDS006378 [2,0,0,0,0,0|1,0,0]=3 30 B10R1.487 OCC1(CCCCC1)CO PH007935 [2,0,0,0,0,0|1,0,0]=3 31 B10R1.487 OCC1(CCNCC1)CO CBR02404 [2,0,0,0,0,0|2,0,0]=4 32 B12R1.1257 CC1(CCCC(=O)C1)CC(=O)O T235539 [1,1,0,0,0,0|0,0,1]=3 33 B12R1.1257 C[C@]1(CCCC(=O)C1)CC(=O)O T291870 [1,1,0,0,0,0|0,0,1]=3 34 B12R1.2629 OCCC1(CCCCC1)CCO PH009734 [1,1,0,0,0,0|1,0,1]=4 35 B12R1.3098 CN(C)C1(CCCCC1)C(=O)O R548529 [0,1,0,0,1,0|2,0,0]=4 36 B12R1.3824 CN1CCC(CC1)(CF)C(=O)O PH018910 [0,1,0,0,1,0|2,0,0]=4 37 B12R1.3861 O=S(=O)(O)C1(CCCCC1)CCl T164070 [0,1,0,0,1,0|2,0,0]=4 38 B14R1.9652 C[C@H]1C[C@H](C[C@@](C1)(CN)CC(=O)O)C PH016612 [0,2,0,0,0,0|0,0,0]=2 39 B12R1.4 CCN1CCC(CC1)CC(=O)O CBR00999 [0,0,1,1,0,0|2,0,0]=4 40 B12R1.1392 O=C(O)CN1CCCCCCC1 T318949 [0,0,1,1,0,0|2,0,0]=4 41 B12R2.19 [C@@H]12CCCC[C@@]1(NC(=O)O2)C T167711 [1,0,0,1,0,0|1,0,0]=3 42 B12R2.411 C=C1CC1C2(CCCCC2)C R238279 [1,0,0,1,0,0|2,0,0]=4 43 B12R2.1153 O=C1CC2CCCC(C1)(C2)O T276936 [1,0,0,1,0,0|2,0,0]=4 44 B12R2.2918 O=C1CC2(CCNCC2)CN1 CDS023378 [1,0,0,1,0,0|2,0,0]=4 45 B12R2.2918 O=C1CCC2(N1)CCCCC2 PH008917 [1,0,0,1,0,0|2,0,0]=4 46 B12R2.2918 O=C1CCC2(O1)CCCCC2 T223042 [1,0,0,1,0,0|2,0,0]=4 47 B12R2.4370 C1CCC2(CC1)CCCNC2 CDS002157 [1,0,0,1,0,0|1,0,1]=4 48 B14R2.31228 O=C(O)C1CSC2(N1)CCCCC2 PH008598 [0,0,0,1,0,1|2,0,0]=4 49 B14R2.30027 N1C(=O)CC2(CCCCC2)CC1=O S354279 [0,1,0,1,0,0|2,0,0]=4 50 B10R0.133 CCCCC(C)(CC)C(=O)O S876577 [0,0,1,0,1,0|1,0,0]=3 51 B10R1.363 CC1(CCCCC1)C(=O)Cl S662380 [1,0,0,0,1,0|1,0,0]=3 52 B10R1.363 CC1(CCCNC1)C(=O)N CBR02426 [1,0,0,0,1,0|2,0,0]=4 53 B10R1.363 CC1(CCCNC1)C(=O)O CBR01687 [1,0,0,0,1,0|1,0,0]=3 54 B10R1.363 CC1(CCCNC1)C(=O)O PHB00204 [1,0,0,0,1,0|1,0,0]=3 55 B10R1.363 CC1(CCNCC1)C(=O)N CBR01691 [1,0,0,0,1,0|2,0,0]=4 56 B10R1.363 CC1(CCNCC1)C(=O)O CBR01543 [1,0,0,0,1,0|1,0,0]=3 57 B10R1.363 C[C@]1(C=CCCC1)C(=O)O T286788 [1,0,0,0,1,0|0,0,2]=4 58 B10R1.363 NC(=O)C1(CCCCC1)Cl PH007086 [1,0,0,0,1,0|2,0,0]=4 59 B10R1.363 NC(=O)C1(CCCCC1)N CBR01964 [1,0,0,0,1,0|1,0,0]=3 60 B10R1.363 NC1(CCCCC1)C(=O)O S235024 [1,0,0,0,1,0|0,0,0]=2 61 B10R1.363 O=C(O)C1(CCNCC1)O CBR01688 [1,0,0,0,1,0|2,0,0]=4 62 B10R1.529 COCC1(CCCC1)CN CBR00880 [1,0,0,0,1,0|2,0,0]=4 63 B12R1.3110 O=C(O)C#CC1(CCCCC1)O TMT00432 [1,0,0,0,0,1|1,0,1]=4