0 B11R0.164 CCCCC(CC)CCC(=O)O SBB067105 [0,0,0,0,0,0|0,0,0]=0 1 B11R0.164 CCCCC(CC)COC(C)=O SBB060584 [0,0,0,0,0,0|2,0,0]=2 2 B10R0.78 CCCCC(C)CCC(=O)O SBB065822 [1,0,0,0,0,0|0,0,0]=1 3 B12R0.216 CCCCC(CC)COC(=O)CCl SBB061271 [0,1,0,0,0,0|2,0,0]=3 4 B12R0.216 CCCCC(CC)COC(=O)CS SBB060345 [0,1,0,0,0,0|1,1,0]=3 5 B12R1.21 CC1CCN(CCC(=O)O)CC1 SBB010527 [0,0,0,1,0,0|1,0,0]=2 6 B12R1.21 CN1CCC(NCC(=O)O)CC1 SBB010544 [0,0,0,1,0,0|2,0,0]=3 7 B12R1.21 CN1CCN(CCC(=O)O)CC1 SBB010546 [0,0,0,1,0,0|2,0,0]=3 8 B12R1.21 CN1CCN(CCC(=O)O)CC1 SBB076293 [0,0,0,1,0,0|2,0,0]=3 9 B12R1.75 CCC1CCCCN1CC(=O)O SBB111674 [0,0,0,1,0,0|1,0,0]=2 10 B12R1.125 CC1CCCCN1CCC(=O)O SBB010526 [0,0,0,1,0,0|1,0,0]=2 11 B12R1.125 O=C(O)CCC1CCCCC1=O SBB010511 [0,0,0,1,0,0|1,0,1]=3 12 B12R1.337 CCCCC1NC(C(=O)O)CS1 SBB300479 [0,0,0,1,0,0|2,0,0]=3 13 B12R1.1343 O=C(O)CCN1CCCCCC1 SBB010525 [0,0,0,1,0,0|1,0,0]=2 14 B12R1.1343 O=C(O)CNC1CCCCCC1 SBB046505 [0,0,0,1,0,0|1,0,0]=2 15 B9R0.40 CCCC(CC)NCCO SBB059831 [2,0,0,0,0,0|1,0,1]=4 16 B9R0.2 CCCCCCCC(=O)Cl SBB060013 [2,0,0,0,0,0|1,0,0]=3 17 B9R0.2 CCCCCCCC(=O)O SBB060020 [2,0,0,0,0,0|0,0,0]=2 18 B9R0.2 CCCCCCCC(C)=O SBB061540 [2,0,0,0,0,0|1,0,0]=3 19 B9R0.2 CCCCCCCC(C)O SBB008521 [2,0,0,0,0,0|1,0,1]=4 20 B9R0.2 CCCCCCCC(N)=O SBB061055 [2,0,0,0,0,0|1,0,0]=3 21 B9R0.2 CCCCCCOC(C)=O SBB060306 [2,0,0,0,0,0|2,0,0]=4 22 B9R0.2 CCCCSCCC(=O)O SBB001705 [2,0,0,0,0,0|1,0,0]=3 23 B9R0.2 NCCCCCCC(=O)O SBB072673 [2,0,0,0,0,0|1,0,0]=3 24 B9R0.2 O=C(O)CCCCCCO SBB059715 [2,0,0,0,0,0|1,0,0]=3 25 B11R0.152 CCCCC(CC)COCCCl SBB059965 [1,1,0,0,0,0|1,0,1]=4 26 B13R0.306 CCCCC(CC)COCC(O)CCl SBB059975 [0,1,0,0,0,1|1,0,1]=4 27 B13R0.305 CCCCC(CC)COC(=O)CC#N SBB068462 [0,2,0,0,0,0|2,0,0]=4 28 B11R1.1 CCCCC1CCC(=O)CC1 SBB059680 [1,0,0,1,0,0|0,0,0]=2 29 B11R1.1 CCCCN1CCC(=O)CC1 SBB087084 [1,0,0,1,0,0|1,0,0]=3 30 B11R1.1 [C@H]1(N)CC[C@@H](CCCC)CC1 SBB059718 [1,0,0,1,0,0|1,0,1]=4 31 B11R1.1 [C@H]1(O)CC[C@H](CCCC)CC1 SBB059708 [1,0,0,1,0,0|0,0,1]=3 32 B11R1.91 O=C(Cl)CCC1CCCCC1 SBB005478 [1,0,0,1,0,0|1,0,0]=3 33 B11R1.91 O=C(O)CCC1CCCCN1 SBB018825 [1,0,0,1,0,0|1,0,0]=3 34 B11R1.91 O=C(O)CCC1CCCNC1 SBB014718 [1,0,0,1,0,0|1,0,0]=3 35 B11R1.91 O=C(O)CCN1CCNCC1 SBB010190 [1,0,0,1,0,0|2,0,0]=4 36 B11R1.91 O=C(O)CCN1CCOCC1 SBB010411 [1,0,0,1,0,0|2,0,0]=4 37 B11R1.91 O=C(O)CCN1CCOCC1 SBB091930 [1,0,0,1,0,0|2,0,0]=4 38 B11R1.266 CCN1CCCC(C(=O)O)C1 SBB303328 [1,0,0,1,0,0|1,0,0]=3 39 B11R1.86 CC(=O)CN1CCCCC1C SBB046421 [1,0,0,1,0,0|2,0,0]=4 40 B11R1.86 CC1CCCCN1CC(=O)O SBB046596 [1,0,0,1,0,0|1,0,0]=3 41 B11R1.86 CN1CCCCC1CC(=O)O SBB010391 [1,0,0,1,0,0|1,0,0]=3 42 B11R1.20 CC1CCN(CC(=O)O)CC1 SBB010388 [0,0,0,1,1,0|1,0,0]=3 43 B11R1.20 CN1CCN(CC(=O)O)CC1 SBB039917 [0,0,0,1,1,0|2,0,0]=4 44 B11R1.20 NC1CCN(CC(=O)O)CC1 SBB014698 [0,0,0,1,1,0|2,0,0]=4 45 B11R1.742 O=C(O)CN1CCCCCC1 SBB010389 [0,0,0,1,1,0|1,0,0]=3 46 B13R1.74 CCCCC1CCC(C(=O)O)CC1 SBB048029 [0,0,0,1,0,1|0,0,0]=2 47 B13R1.74 [C@H]1(CCCC)CC[C@@H](C(=O)O)CC1 SBB059719 [0,0,0,1,0,1|0,0,0]=2 48 B13R1.513 CN1CCN(CCCC(=O)O)CC1 SBB077221 [0,0,0,1,0,1|2,0,0]=4 49 B13R1.1988 O=C(O)CCCN1CCCCCC1 SBB077232 [0,0,0,1,0,1|1,0,0]=3 50 B13R1.562 CCCCN1CC(C(=O)O)CC1=O SBB045165 [0,1,0,1,0,0|1,0,1]=4 51 B13R1.3787 CC1CCCC(C)N1CCC(=O)O SBB046515 [0,1,0,1,0,0|1,0,0]=3 52 B13R1.3 CCN1CCN(CCC(=O)O)CC1 SBB048773 [0,1,0,1,0,0|1,0,0]=3 53 B13R1.132 CN1CCC(N(C)CC(=O)O)CC1 SBB301607 [0,1,0,1,0,0|2,0,0]=4 54 B13R1.528 COC(=O)CCN1CCCCC1C SBB046521 [0,1,0,1,0,0|1,0,0]=3 55 B13R1.1711 COC(=O)CCN1CCCCCC1 SBB046517 [0,1,0,1,0,0|1,0,0]=3 56 B13R2.435 O=C(O)C1CC2CCCCC2N1 SBB066619 [0,0,0,2,0,0|1,0,0]=3 57 B9R0.14 CCCC(CC)OC(C)=O SBB060029 [1,0,0,0,1,0|2,0,0]=4 58 B9R0.4 COCCN(C)CC(=O)O SBB046598 [1,0,0,0,1,0|2,0,0]=4 59 B9R0.13 CCCCC(CC)C(=O)Cl SBB058897 [0,0,0,0,2,0|1,0,0]=3 60 B9R0.13 CCCCC(CC)C(=O)O SBB060021 [0,0,0,0,2,0|0,0,0]=2 61 B9R0.13 CCCCC(CC)C(N)=O SBB061054 [0,0,0,0,2,0|1,0,0]=3