0 B10R0.74 C#CCCCCCC(=O)OC AT21753 [0,0,0,0,0,0|1,0,2]=3 1 B10R0.74 COC(=O)COCCCCO AT19930 [0,0,0,0,0,0|3,0,0]=3 2 B9R0.2 CNCCOCCC(=O)O C70436 [1,0,0,0,0,0|3,0,0]=4 3 B9R0.45 CC\C=C\CCCCC=O P17001 [1,0,0,0,0,0|1,0,2]=4 4 B9R0.46 C#CCCCCC(=O)OC AT21754 [1,0,0,0,0,0|1,0,2]=4 5 B9R0.46 COC(=O)CCOCCO C70644 [1,0,0,0,0,0|3,0,0]=4 6 B9R0.46 COC(=O)CSCCCO AT19328 [1,0,0,0,0,0|3,0,0]=4 7 B11R0.40 C#CCCCCCCC(=O)OC AT21756 [0,1,0,0,0,0|1,0,1]=3 8 B11R1.1 CN1CCC(CCCN)CC1 AT26530 [0,0,0,1,0,0|3,0,0]=4 9 B11R1.25 COC(=O)CC[C@H]1CCNC1 AC9534 [0,0,0,1,0,0|2,0,0]=3 10 B11R1.40 COC(=O)C[C@H]1CNCCN1 AT13567 [0,0,0,1,0,0|3,0,0]=4 11 B11R1.40 COC(=O)C[C@H]1CNCCS1 AT25874 [0,0,0,1,0,0|3,0,0]=4 12 B11R1.222 COC(=O)[C@@H]1COCC[C@@H]1N C16229 [0,0,0,1,0,0|3,0,0]=4 13 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N AC4604 [0,0,0,1,0,0|2,0,0]=3 14 B11R1.222 COC(=O)[C@H]1CCCN[C@H]1C F14148 [0,0,0,1,0,0|2,0,0]=3 15 B11R1.852 COC(=O)[C@@H]1CCOCCN1 D76197 [0,0,0,1,0,0|3,0,0]=4 16 B11R1.852 COC(=O)[C@@H]1CCOCCN1 D76198 [0,0,0,1,0,0|3,0,0]=4 17 B11R1.852 COC(=O)[C@@H]1CNCCCN1 AC3242 [0,0,0,1,0,0|3,0,0]=4 18 B11R1.852 COC(=O)[C@@H]1COCCCN1 D76195 [0,0,0,1,0,0|3,0,0]=4 19 B11R1.852 COC(=O)[C@@H]1COCCCN1 D76196 [0,0,0,1,0,0|3,0,0]=4 20 B11R1.852 COC(=O)[C@H]1CCCCNC1 81273 [0,0,0,1,0,0|2,0,0]=3 21 B10R0.75 CSCCCC[C@H](N)C(=O)O 70962 [1,1,0,0,0,0|2,0,0]=4 22 B10R0.75 NCCCCC[C@H](N)C(=O)O AT25880 [1,1,0,0,0,0|2,0,0]=4 23 B10R0.83 COC(=O)[C@@H](N)CCCCF AT15761 [1,1,0,0,0,0|2,0,0]=4 24 B10R0.83 COC(=O)[C@@H](N)CCCCF AT15765 [1,1,0,0,0,0|2,0,0]=4 25 B10R0.83 COC(=O)[C@@H](N)CCCCO AC3241 [1,1,0,0,0,0|2,0,0]=4 26 B12R0.1 CCOC(=O)COCCCCCO AT19860 [0,2,0,0,0,0|1,0,0]=3 27 B12R0.1 CCOC(=O)COCCOCCO AT11840 [0,2,0,0,0,0|2,0,0]=4 28 B12R0.1 CCOC(=O)COCCOCCO D84682 [0,2,0,0,0,0|2,0,0]=4 29 B12R0.142 CCCCOC(=O)CCC(=O)OC AT21856 [0,2,0,0,0,0|1,0,1]=4 30 B12R0.248 C#CCCCCCCCC(=O)OC AT21757 [0,2,0,0,0,0|1,0,0]=3 31 B12R0.248 COC(=O)CCOCCOCCO C70643 [0,2,0,0,0,0|2,0,0]=4 32 B12R0.189 COC(=O)CCN(C)CCC(C)C D72659 [0,2,0,0,0,0|2,0,0]=4 33 B12R0.216 CCCC[C@H](CC)COC(=O)CC D75927 [0,2,0,0,0,0|1,0,0]=3 34 B10R1.10 CCC[C@H]1CCNC(=O)C1 AC9817 [1,0,0,1,0,0|1,0,0]=3 35 B10R1.18 CC(=O)N[C@H]1CCCNC1 D76222 [1,0,0,1,0,0|2,0,0]=4 36 B10R1.18 O=C(O)C[C@H]1CCCCN1 C16162 [1,0,0,1,0,0|2,0,0]=4 37 B10R1.61 C[C@@H]1CCNC[C@@H]1C(=O)O AT24543 [1,0,0,1,0,0|2,0,0]=4 38 B10R1.61 C[C@H]1CCNC[C@@H]1C(=O)O AT24544 [1,0,0,1,0,0|2,0,0]=4 39 B10R1.348 O=C(O)[C@@H]1CCCCCN1 98555 [1,0,0,1,0,0|2,0,0]=4 40 B10R1.348 O=C(O)[C@@H]1CCCCCN1 98556 [1,0,0,1,0,0|2,0,0]=4 41 B10R1.348 O=C(O)[C@H]1CCCCNC1 F16355 [1,0,0,1,0,0|2,0,0]=4 42 B10R1.348 O=C(O)[C@H]1CCCOCC1 85693 [1,0,0,1,0,0|2,0,0]=4 43 B10R1.348 O=C(O)[C@H]1CCCOCC1 85694 [1,0,0,1,0,0|2,0,0]=4 44 B10R1.1 CCON1CCC(=O)CC1 92110 [1,0,0,1,0,0|2,0,0]=4 45 B10R1.15 CCC(=O)N1CCCNC1 AC9409 [1,0,0,1,0,0|2,0,0]=4 46 B10R1.15 O=C(CBr)[C@H]1CCCOC1 AT13307 [1,0,0,1,0,0|2,0,0]=4 47 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1O C14390 [1,0,0,1,0,0|2,0,0]=4 48 B10R1.151 COC(=O)CCC1CNC1 AT26042 [1,0,0,1,0,0|2,0,0]=4 49 B10R1.157 COC(=O)C[C@@H]1C[C@@H]1CO F51543 [1,0,0,1,0,0|2,0,0]=4 50 B10R1.175 COC(=O)C1CCC1CO W15653 [1,0,0,1,0,0|2,0,0]=4 51 B12R1.308 CCOC(=O)[C@@H]1CCOC[C@@H]1N 56732 [0,1,0,1,0,0|2,0,0]=4 52 B12R1.308 CCOC(=O)[C@@H]1COCC[C@@H]1N F50155 [0,1,0,1,0,0|2,0,0]=4 53 B12R1.316 CCOC(=O)[C@H]1CNC[C@@H]1OC P17332 [0,1,0,1,0,0|2,0,0]=4 54 B12R1.1564 CCOC(=O)[C@H]1CCCNCC1 AT25596 [0,1,0,1,0,0|1,0,0]=3 55 B12R1.371 COC(=O)CC1CCCCC1O AT25971 [0,1,0,1,0,0|1,0,0]=3 56 B12R1.371 COC(=O)C[C@H]1CCCC[C@@H]1N AT25947 [0,1,0,1,0,0|1,0,0]=3 57 B12R1.371 COC(=O)C[C@H]1CCCC[C@@H]1N AT25948 [0,1,0,1,0,0|1,0,0]=3 58 B12R1.43 CN(C)C(=O)C[C@H]1CCCCN1 AT26649 [0,1,0,1,0,0|2,0,0]=4 59 B12R1.108 COC(=O)[C@@H](N)CC1CCCC1 67403 [0,1,0,1,0,0|1,0,0]=3 60 B12R1.1731 COC(=O)[C@]1(C)CCCCCN1 E73333 [0,1,0,1,0,0|2,0,0]=4 61 B12R2.24 O=C1CC[C@H]2CNCCN2C1 AT18736 [0,0,0,2,0,0|2,0,0]=4 62 B12R2.1175 NC1CCC2(CCCC2)CC1 D73445 [0,0,0,2,0,0|1,0,1]=4 63 B12R2.1175 O=C1CCC2(CCNC2)CC1 91365 [0,0,0,2,0,0|1,0,0]=3 64 B12R2.1175 O=C1CCC2(CCOC2)CC1 38221 [0,0,0,2,0,0|1,0,0]=3 65 B12R2.1175 OC1CCC2(CCCC2)CC1 D73446 [0,0,0,2,0,0|0,0,2]=4 66 B12R2.2302 O=C1CCN(C2CCC2)CC1 91457 [0,0,0,2,0,0|1,0,0]=3 67 B12R2.1081 NC1CCCC2CCCCC12 W19620 [0,0,0,2,0,0|1,0,1]=4 68 B12R2.1081 O=C1CCCN2CCSC[C@@H]12 E73171 [0,0,0,2,0,0|2,0,0]=4 69 B12R2.1081 O=C1CCNC2CCCCC12 AT25785 [0,0,0,2,0,0|1,0,0]=3 70 B12R2.1542 COC(=O)C1CC2CNCC21 D72832 [0,0,0,2,0,0|2,0,0]=4 71 B12R2.1596 COC(=O)C1CC2CCC1N2 F53783 [0,0,0,2,0,0|2,0,0]=4 72 B12R2.2918 O=C1NC2(CCCCC2)CO1 F53261 [0,0,0,2,0,0|2,0,0]=4 73 B12R2.3810 COC(=O)C1C2CNCC1C2 P19391 [0,0,0,2,0,0|2,0,0]=4 74 B12R2.296 COC(=O)[C@H]1CCNC12CC2 AT20134 [0,0,0,2,0,0|2,0,0]=4 75 B12R2.455 O=C1CNC[C@H]2CCCN1C2 P12310 [0,0,0,2,0,0|2,0,0]=4 76 B12R2.3539 COC(=O)[C@H]1CCC12CNC2 D73432 [0,0,0,2,0,0|2,0,0]=4 77 B12R2.469 O=C1CCCN(C2CC2)CC1 AC4527 [0,0,0,2,0,0|1,0,0]=3 78 B12R2.1541 COC(=O)C12CCNCC1C2 D73109 [0,0,0,2,0,0|2,0,0]=4 79 B12R2.1541 COC(=O)C12CNCCC1C2 D73110 [0,0,0,2,0,0|2,0,0]=4