0 B11R0.4 CCOC(=O)CCCCCCBr AK-68411 [0,0,0,0,0,0|1,0,0]=1 1 B11R0.4 O=C(OCC)CCCCCCN AK-41611 [0,0,0,0,0,0|1,0,0]=1 2 B10R0.1 CCOC(=O)CCCCCBr AK111109 [1,0,0,0,0,0|1,0,0]=2 3 B10R0.1 O=C(OCC)CCCCCN AK145590 [1,0,0,0,0,0|1,0,0]=2 4 B10R0.1 O=C(OCC)CNCCC#N AK188033 [1,0,0,0,0,0|2,0,1]=4 5 B10R0.74 CCCCCCCC(NN)=O AK117029 [1,0,0,0,0,0|2,0,0]=3 6 B10R0.74 CCCCCCCC(NO)=O AK-43792 [1,0,0,0,0,0|2,0,0]=3 7 B10R0.74 COC(CCCCCCBr)=O AK-29360 [1,0,0,0,0,0|1,0,0]=2 8 B10R0.74 O=C(OC)CCCCCCN AK-61182 [1,0,0,0,0,0|1,0,0]=2 9 B12R0.1 CCCCCCCCC(OCC)=O AK113976 [0,1,0,0,0,0|0,0,0]=1 10 B12R0.114 O=C(OCC)C(CCCCCCl)=O AK-92969 [0,1,0,0,0,0|1,0,1]=3 11 B12R0.285 O=C(OCC)CCCC(OCC)=O AK112428 [0,1,0,0,0,0|1,0,1]=3 12 B12R0.285 O=C(OCC)CNCC(OCC)=O AK-82275 [0,1,0,0,0,0|2,0,1]=4 13 B12R1.28 O=C1CCCC(CCCCC)O1 AK105335 [0,0,0,1,0,0|2,0,0]=3 14 B12R1.32 O=C(OCC)CC1CCNCC1 AK-62757 [0,0,0,1,0,0|1,0,0]=2 15 B12R1.32 O=C(OCC)CC1CCOCC1 AK-45451 [0,0,0,1,0,0|1,0,0]=2 16 B12R1.32 O=C(OCC)CC1CNCCC1 AK-62785 [0,0,0,1,0,0|1,0,0]=2 17 B12R1.32 O=C(OCC)\C=C/1CNCCC1 AK-85647 [0,0,0,1,0,0|1,0,2]=4 18 B12R1.32 O=C(OCC)\C=C\1CNCCC1 AK101020 [0,0,0,1,0,0|1,0,2]=4 19 B12R1.308 C(OC(=O)C1C(=O)CCCC1)C AK-41453 [0,0,0,1,0,0|1,0,1]=3 20 B12R1.308 CCOC(=O)C1=C(N)CCCC1 AK-83411 [0,0,0,1,0,0|1,0,2]=4 21 B12R1.308 CCOC(=O)C1CCNCC1=O AK-41235 [0,0,0,1,0,0|2,0,1]=4 22 B12R1.308 CCOC(=O)C1COCCC1=O AK-68860 [0,0,0,1,0,0|2,0,1]=4 23 B12R1.308 O=C(C1CNCCC1=O)OCC AK-47659 [0,0,0,1,0,0|2,0,1]=4 24 B12R1.308 O=C(C1N(C)CCCC1)OCC AK-75846 [0,0,0,1,0,0|1,0,0]=2 25 B12R1.308 O=C([C@H]1[C@@H](O)CCCC1)OCC AK173002 [0,0,0,1,0,0|1,0,0]=2 26 B12R1.308 O=C([C@H]1[C@H](O)CCCC1)OCC AK-81366 [0,0,0,1,0,0|1,0,0]=2 27 B12R1.308 O=C1NCCCC1C(OCC)=O AK-34903 [0,0,0,1,0,0|2,0,1]=4 28 B12R1.310 CCOC(=O)CCCNC1CC1 AK-82221 [0,0,0,1,0,0|1,0,0]=2 29 B12R1.318 O=C(OCC)CC1C(CCC1)=O AK-48019 [0,0,0,1,0,0|1,0,1]=3 30 B9R0.5 C(C(OCC)=O)CCCBr AK-46515 [2,0,0,0,0,0|1,0,0]=3 31 B9R0.5 NCCCCC(=O)OCC AK-41723 [2,0,0,0,0,0|1,0,0]=3 32 B9R0.5 O=C(OCC)COCCCl AK-86508 [2,0,0,0,0,0|2,0,0]=4 33 B9R0.45 CCCCCCCCCBr AK164444 [2,0,0,0,0,0|1,0,1]=4 34 B9R0.46 O=C(OC)CCCCCBr AK113951 [2,0,0,0,0,0|1,0,0]=3 35 B9R0.46 O=C(OC)CCCCCN AK-47079 [2,0,0,0,0,0|1,0,0]=3 36 B9R0.2 C=CCCCCCC(O)=O AK164507 [2,0,0,0,0,0|0,0,2]=4 37 B9R0.2 CCCCCCCB(O)O AK145619 [2,0,0,0,0,0|1,0,1]=4 38 B9R0.2 O=C(O)CCCCCCN AK-47536 [2,0,0,0,0,0|1,0,0]=3 39 B9R0.2 OC(=O)CCCCCCBr AK-28585 [2,0,0,0,0,0|1,0,0]=3 40 B9R0.2 OCCCCCCC(O)=O AK-29232 [2,0,0,0,0,0|1,0,0]=3 41 B11R0.62 O=C(OCC)CCC(OCC)=O AK151972 [1,1,0,0,0,0|1,0,1]=4 42 B11R0.155 [C@H](N)(CCCCN)C(=O)OCC AK-49745 [1,1,0,0,0,0|1,0,0]=3 43 B11R0.42 CCCCCCCC(=O)N(C)C AK-87625 [1,1,0,0,0,0|1,0,0]=3 44 B13R0.367 C(C(Cl)CCCl)CCCC(OCC)=O AK-39883 [0,2,0,0,0,0|0,0,0]=2 45 B13R0.367 CCOC(=O)CCCCC(=O)OCC AK111118 [0,2,0,0,0,0|0,0,1]=3 46 B13R0.286 O=C(OC(C)(C)C)NCCCCCBr AK135268 [0,2,0,0,0,0|2,0,0]=4 47 B13R0.286 O=C(OC(C)(C)C)NCCCCCN AK-35425 [0,2,0,0,0,0|2,0,0]=4 48 B13R0.18 N[C@@H](CCC(OCC)=O)C(OCC)=O AK-47724 [0,2,0,0,0,0|1,0,1]=4 49 B13R0.18 O=C(OCC)C(O)CCC(OCC)=O AK158429 [0,2,0,0,0,0|1,0,1]=4 50 B13R0.18 O=C(OCC)[C@H](N)CCC(OCC)=O AK202908 [0,2,0,0,0,0|1,0,1]=4 51 B11R1.16 C(OC(C1CCCNC1)=O)C AK-50734 [1,0,0,1,0,0|1,0,0]=3 52 B11R1.16 C(OC(C1CCNCC1)=O)C AK-50644 [1,0,0,1,0,0|1,0,0]=3 53 B11R1.16 CCOC(=O)N1CCCCC1 AK-76918 [1,0,0,1,0,0|1,0,0]=3 54 B11R1.16 O=C(C1CCNCC1)OCC AK114998 [1,0,0,1,0,0|1,0,0]=3 55 B11R1.16 O=C(C1CCOCC1)OCC AK-55948 [1,0,0,1,0,0|1,0,0]=3 56 B11R1.16 O=C(C1CNCCC1)OCC AK-45217 [1,0,0,1,0,0|1,0,0]=3 57 B11R1.16 O=C(C1CNCCO1)OCC AK-32010 [1,0,0,1,0,0|2,0,0]=4 58 B11R1.16 O=C(C1NCCCC1)OCC AK117282 [1,0,0,1,0,0|1,0,0]=3 59 B11R1.16 O=C(C1NCCNC1)OCC AK-82337 [1,0,0,1,0,0|2,0,0]=4 60 B11R1.16 O=C([C@@H]1CNCCC1)OCC AK-50723 [1,0,0,1,0,0|1,0,0]=3 61 B11R1.16 O=C([C@H]1CNCCC1)OCC AK-41584 [1,0,0,1,0,0|1,0,0]=3 62 B11R1.16 O=C([C@H]1CNCCC1)OCC AK-45083 [1,0,0,1,0,0|1,0,0]=3 63 B11R1.16 O=C([C@H]1CNCCC1)OCC AK-50703 [1,0,0,1,0,0|1,0,0]=3 64 B11R1.16 O=C([C@H]1NCCCC1)OCC AK-97255 [1,0,0,1,0,0|1,0,0]=3 65 B11R1.30 CCOC(=O)CC1CCNC1 AK-64695 [1,0,0,1,0,0|1,0,0]=3 66 B11R1.30 O=C(OCC)CC1OCCC1 AK154820 [1,0,0,1,0,0|1,0,0]=3 67 B11R1.199 C(OC(C1C(CCC1)=O)=O)C AK-47297 [1,0,0,1,0,0|1,0,1]=4 68 B11R1.199 O=C([C@H]1[C@@H](O)CCC1)OCC AK306178 [1,0,0,1,0,0|1,0,0]=3 69 B11R1.25 O=C(OC)CNC1CCCC1 AK-47989 [1,0,0,1,0,0|1,0,0]=3 70 B11R1.25 O=C(OC)CO[C@H]1CNCC1 AK554554 [1,0,0,1,0,0|2,0,0]=4 71 B11R1.27 O=C1OC(CCCCC)CC1 AK551064 [1,0,0,1,0,0|1,0,0]=3 72 B11R1.40 COC(=O)CC1CCOCC1 AK-76203 [1,0,0,1,0,0|1,0,0]=3 73 B11R1.40 O=C(OC)CC1CCNCC1 AK-44290 [1,0,0,1,0,0|1,0,0]=3 74 B11R1.40 O=C(OC)C[C@@H]1NCCOC1 AK165141 [1,0,0,1,0,0|2,0,0]=4 75 B11R1.222 O=C(C1CNCCC1O)OC AK554356 [1,0,0,1,0,0|2,0,0]=4 76 B11R1.222 O=C(C1N(C)CCNC1)OC AK-64634 [1,0,0,1,0,0|2,0,0]=4 77 B13R1.463 O=C(C1CCNCCC1=O)OCC AK162703 [0,1,0,1,0,0|1,0,1]=4 78 B13R1.348 O=C(OC(Cl)C)OC1CCCCC1 AK-86219 [0,1,0,1,0,0|1,0,0]=3 79 B13R1.33 O=C(OCC)CC(C1CCCC1)=O AK-34344 [0,1,0,1,0,0|0,0,1]=3 80 B13R1.33 O=C(OCC)CC(C1OCCC1)=O AK-83463 [0,1,0,1,0,0|1,0,1]=4 81 B13R1.2570 C(C1(CCCCC1)O)C(OCC)=O AK-32317 [0,1,0,1,0,0|0,0,0]=2 82 B13R1.19 CCOC(=O)C[C@H]1CC[C@H](N)CC1 AK-83345 [0,1,0,1,0,0|0,0,0]=2 83 B13R1.19 O=C(OCC)CC1CCC(CC1)=O AK114276 [0,1,0,1,0,0|0,0,1]=3 84 B13R1.1515 O=C(C1C(C(OCC)=O)C1)OCC AK-45617 [0,1,0,1,0,0|1,0,1]=4 85 B13R2.11128 O=C1CC2(CCNCC2)CCN1 AK199213 [0,0,0,2,0,0|2,0,0]=4 86 B13R2.15 O=C1CCCN1C2CCCCC2 AK-90137 [0,0,0,2,0,0|2,0,0]=4