0 B10R1.10 O=C1CC(CCC)NCC1 AK129486 [1,0,0,0,0,0|2,0,0]=3 1 B10R1.17 C(CCC)C1CCNCC1 AK-27060 [1,0,0,0,0,0|2,0,1]=4 2 B12R1.17 O=C(C1CC(CCC1)=O)OCC AK-45206 [0,1,0,0,0,0|2,0,1]=4 3 B12R1.28 O=C1CCCC(CCCCC)O1 AK105335 [0,1,0,0,0,0|0,0,0]=1 4 B10R0.1 CCOC(=O)CCCCCBr AK111109 [0,0,1,0,0,0|3,0,0]=4 5 B10R0.1 O=C(OCC)CCCCCN AK145590 [0,0,1,0,0,0|3,0,0]=4 6 B10R0.4 CCCCCCCCB(O)O AK-84208 [0,0,1,0,0,0|1,0,1]=3 7 B10R0.4 O=C(O)CCCCCCCBr AK-33752 [0,0,1,0,0,0|1,0,0]=2 8 B10R0.4 O=C(O)CCCCCCCN AK-45259 [0,0,1,0,0,0|1,0,0]=2 9 B10R0.4 O=C(O)COCCOCCN AK-33158 [0,0,1,0,0,0|3,0,0]=4 10 B10R0.4 O=C(O)COCCOCCN AK-90200 [0,0,1,0,0,0|3,0,0]=4 11 B12R2.24 O=C1CCC2CCCCC2O1 AK554624 [0,0,0,1,0,0|0,0,0]=1 12 B9R0.5 C(C(OCC)=O)CCCBr AK-46515 [1,0,1,0,0,0|2,0,0]=4 13 B9R0.5 NCCCCC(=O)OCC AK-41723 [1,0,1,0,0,0|2,0,0]=4 14 B9R0.5 O=C(OCCCC)CC#N AK109261 [1,0,1,0,0,0|1,0,1]=4 15 B9R0.45 C=CCCCCCCCBr AK161876 [1,0,1,0,0,0|2,0,0]=4 16 B9R0.45 C=CCCCCCCCCl AK164575 [1,0,1,0,0,0|2,0,0]=4 17 B9R0.45 CCCCCCCCCBr AK164444 [1,0,1,0,0,0|1,0,1]=4 18 B9R0.45 OCCCCCCCCBr AK113930 [1,0,1,0,0,0|1,0,1]=4 19 B9R0.2 C=CCCCCCC(O)=O AK164507 [1,0,1,0,0,0|0,0,2]=4 20 B9R0.2 CCCCCCCB(O)O AK145619 [1,0,1,0,0,0|1,0,1]=4 21 B9R0.2 O=C(O)CCCCCCN AK-47536 [1,0,1,0,0,0|1,0,0]=3 22 B9R0.2 OC(=O)CCCCCCBr AK-28585 [1,0,1,0,0,0|1,0,0]=3 23 B9R0.2 OCCCCCCC(O)=O AK-29232 [1,0,1,0,0,0|1,0,0]=3 24 B9R1.8 CCC[C@@H]1NCCCC1 AK608023 [2,0,0,0,0,0|1,0,1]=4 25 B11R0.4 CCOC(=O)CCCCCCBr AK-68411 [0,1,1,0,0,0|2,0,0]=4 26 B11R0.4 O=C(OCC)CCCCCCN AK-41611 [0,1,1,0,0,0|2,0,0]=4 27 B11R0.30 C(C(O)=O)CCCCCC(O)=O AK-73011 [0,1,1,0,0,0|1,0,1]=4 28 B11R0.40 CCCCCC\C=C\C(OC)=O AK112231 [0,1,1,0,0,0|0,0,2]=4 29 B11R0.42 CCCCCCC[C@H](N)C(O)=O AK-58077 [0,1,1,0,0,0|0,0,0]=2 30 B11R0.46 CCCCCC(C)CCC(O)=O AK112837 [0,1,1,0,0,0|0,0,0]=2 31 B11R0.46 O=C(O)CCN(C)CCCCC AK-35893 [0,1,1,0,0,0|1,0,0]=3 32 B11R0.148 OC(=O)CCCCCCCCBr AK-49777 [0,1,1,0,0,0|0,0,0]=2 33 B11R0.148 OCCCCCCCCC(O)=O AK-77678 [0,1,1,0,0,0|0,0,0]=2 34 B11R0.159 CCCCCCCCP(O)(O)=O AK-48059 [0,1,1,0,0,0|1,0,0]=3 35 B11R0.159 CCCCCCCCS(=O)([O-])=O AK-86035 [0,1,1,0,0,0|1,0,1]=4 36 B11R1.28 BrCCCOC1CCCCO1 AK116232 [1,1,0,0,0,0|1,0,1]=4 37 B11R1.27 O=C1OC(CCCCC)CC1 AK551064 [0,1,0,0,1,0|0,0,0]=2 38 B11R1.199 C(OC(C1C(CCC1)=O)=O)C AK-47297 [0,1,0,0,1,0|1,0,1]=4 39 B11R1.20 CC(=O)NC1CCC(O)CC1 AK109437 [0,0,1,1,0,0|2,0,0]=4 40 B11R1.20 CC(OC1CCC(CC1)=O)=O AK112287 [0,0,1,1,0,0|1,0,1]=4 41 B11R2.20 C1CCC2NCCCC2C1 AK-51658 [1,0,0,1,0,0|1,0,1]=4 42 B11R2.1261 C1NCCC12OCCCC2 AK130850 [1,0,0,1,0,0|1,0,1]=4 43 B11R2.1261 C1NCCC12OCCCC2 AK486918 [1,0,0,1,0,0|1,0,1]=4 44 B11R2.3 O=C1NCCC12CNCC2 AK122730 [0,0,0,1,1,0|2,0,0]=4 45 B13R2.11128 O=C1CC2(CCNCC2)CCN1 AK199213 [0,1,0,1,0,0|2,0,0]=4 46 B13R2.11128 O=C1OC2(CCNCC2)CCN1 AK151128 [0,1,0,1,0,0|1,0,0]=3 47 B13R2.13501 O=C1CC(CC2(C1)CCCC2)=O AK154743 [0,1,0,1,0,0|1,0,1]=4 48 B13R2.13501 O=C1CC(OC2(O1)CCCC2)=O AK-32480 [0,1,0,1,0,0|1,0,1]=4 49 B9R0.13 CCCCC(CC)C([O-])=O AK159156 [0,0,1,0,1,0|1,0,0]=3 50 B9R1.7 O=C1OC[C@H](CCC)C1 AK543520 [1,0,0,0,1,0|2,0,0]=4 51 B9R1.12 ClCCCC1OCCO1 AK-60697 [1,0,0,0,1,0|2,0,0]=4 52 B11R0.164 CCCCC(CC)CCC(O)=O AK-60980 [0,0,1,0,0,1|2,0,0]=4