0 B12R0.42 NC(=O)NCCCC[C@H](N)C(=O)O Z3466304206 [0,0,0,0,0,0|1,0,0]=1 1 B11R0.30 CC(=O)CCCCCCC(=O)C Z1198162235 [1,0,0,0,0,0|3,0,0]=4 2 B11R0.30 CC(=O)CCCCCCC(=O)O Z1262510893 [1,0,0,0,0,0|2,0,0]=3 3 B11R0.30 CC(=O)NCCCCCC(=O)N Z68591091 [1,0,0,0,0,0|2,0,0]=3 4 B11R0.30 CC(=O)NCCCCCC(=O)O Z56914861 [1,0,0,0,0,0|1,0,0]=2 5 B11R0.30 NC(=O)NCCCCCC(=O)O Z90122369 [1,0,0,0,0,0|1,0,0]=2 6 B11R0.30 O=C(O)CCCCCCC(=O)O Z104473456 [1,0,0,0,0,0|1,0,0]=2 7 B11R0.30 O=C(O)COCCOCC(=O)O Z104477844 [1,0,0,0,0,0|3,0,0]=4 8 B11R0.42 C#CCCCCCC(N)C(=O)O Z4920921873 [1,0,0,0,0,0|2,0,1]=4 9 B13R0.353 NC(CSSCC(N)C(=O)O)C(=O)O Z56346947 [0,1,0,0,0,0|3,0,0]=4 10 B13R0.353 N[C@@H](CSSC[C@H](N)C(=O)O)C(=O)O Z1269145231 [0,1,0,0,0,0|3,0,0]=4 11 B13R0.353 N[C@H](CSSC[C@@H](N)C(=O)O)C(=O)O Z1269180278 [0,1,0,0,0,0|3,0,0]=4 12 B11R0.29 CC(=O)C(C)CCCCC(=O)O Z1262513809 [0,0,0,0,1,0|2,0,0]=3 13 B11R0.29 CC(=O)NCCC[C@H](N)C(=O)O Z3661982306 [0,0,0,0,1,0|1,0,0]=2 14 B11R0.29 N=C(N)NCCCC(N)C(=O)O Z56896349 [0,0,0,0,1,0|2,0,0]=3 15 B11R0.29 N=C(N)NCCC[C@@H](N)C(=O)O Z1201618596 [0,0,0,0,1,0|2,0,0]=3 16 B11R0.29 N=C(N)NCCC[C@H](N)C(=O)O Z1143220275 [0,0,0,0,1,0|2,0,0]=3 17 B11R0.29 NC(=O)NCCC[C@@H](N)C(=O)O Z1255438848 [0,0,0,0,1,0|1,0,0]=2 18 B11R0.29 NC(=O)NCCC[C@H](N)C(=O)O Z1198149761 [0,0,0,0,1,0|1,0,0]=2 19 B12R0.137 CS(=O)(=O)NCCCCCC(=O)O Z54814595 [1,1,0,0,0,0|1,0,1]=4 20 B12R0.184 COC(=O)CCCCCNC(=O)N Z90067573 [1,1,0,0,0,0|1,0,0]=3 21 B12R0.184 COC(=O)CCCCCNC(=S)N Z90122771 [1,1,0,0,0,0|1,1,0]=4 22 B12R0.184 O=C(O)CCCCCNC(=O)CCl Z56979358 [1,1,0,0,0,0|1,0,0]=3 23 B12R1.226 O=C(O)CCC1CCCC(=O)N1 Z1262514420 [1,0,0,1,0,0|2,0,0]=4 24 B12R1.261 CC(=O)N1CCCCC1C(=O)O Z85895893 [1,0,0,1,0,0|1,0,0]=3 25 B12R1.261 CC(=O)N1CCOCC1C(=O)O Z1258978283 [1,0,0,1,0,0|2,0,0]=4 26 B12R1.261 NC(=O)[C@@H]1CCCC[C@@H]1C(=O)O Z1955831204 [1,0,0,1,0,0|2,0,0]=4 27 B12R1.261 O=C(O)C1CCCNC1C(=O)O Z4868649122 [1,0,0,1,0,0|2,0,0]=4 28 B12R1.261 O=C(O)C1CCNCC1C(=O)O Z1655104197 [1,0,0,1,0,0|2,0,0]=4 29 B12R1.392 CC(=O)N1CCCC1CC(=O)O Z808565612 [1,0,0,1,0,0|1,0,0]=3 30 B12R1.392 O=C(O)CN1CCCC1C(=O)O Z2694339170 [1,0,0,1,0,0|2,0,0]=4 31 B12R1.874 O=C(O)CC1CCCCC(=O)N1 Z1262554304 [1,0,0,1,0,0|2,0,0]=4 32 B12R1.874 O=C(O)CC1CCCNC(=O)C1 Z1262530488 [1,0,0,1,0,0|1,0,0]=3 33 B12R1.1011 O=C1CCCCCC(C1)C(=O)O Z1262523591 [1,0,0,1,0,0|2,0,0]=4 34 B12R1.43 NC(CC1CCCCO1)C(=O)O Z1699857633 [1,0,0,1,0,0|1,0,1]=4 35 B12R1.43 N[C@@H](CC1CCNCC1)C(=O)O Z4635347562 [1,0,0,1,0,0|1,0,1]=4 36 B12R1.1035 CC1(CCCCNC1=O)C(=O)O Z3492502420 [1,0,0,1,0,0|1,0,0]=3 37 B12R1.224 NC1CCCN(C1=O)CC(=O)O Z3484325049 [1,0,0,1,0,0|2,0,0]=4 38 B12R1.258 CC(=O)N1CCCC(C1)C(=O)O Z85893766 [0,0,0,1,1,0|2,0,0]=4 39 B12R1.258 NC(=O)C1CCCC(C1)C(=O)O Z1157726699 [0,0,0,1,1,0|2,0,0]=4 40 B12R1.258 NC(=O)N1CCCC(C1)C(=O)O Z104510598 [0,0,0,1,1,0|2,0,0]=4 41 B12R1.258 O=C(O)C1CCCC(C1)C(=O)O Z443356938 [0,0,0,1,1,0|1,0,0]=3 42 B12R1.258 O=C(O)C1CSCC(N1)C(=O)O Z3824194582 [0,0,0,1,1,0|1,0,0]=3 43 B12R1.258 O=C(O)[C@@H]1CSC[C@H](N1)C(=O)O Z3913098746 [0,0,0,1,1,0|1,0,0]=3 44 B12R1.258 O=C(O)[C@H]1CCC[C@H](C1)C(=O)O Z1255446499 [0,0,0,1,1,0|1,0,0]=3 45 B14R2.8653 O=C(O)C1CCC(=O)N2C1CCC2 Z2732583386 [0,0,0,2,0,0|2,0,0]=4 46 B14R2.83297 N[C@]1(CC[C@@H]2[C@H]1[C@H]2C(=O)O)C(=O)O Z360056588 [0,0,0,2,0,0|1,0,0]=3 47 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O Z1222399234 [0,0,0,0,2,0|1,0,0]=3 48 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O Z1255486317 [0,0,0,0,2,0|0,0,0]=2 49 B12R0.268 CC(=O)NCCCCCNC(=O)C Z1509147903 [1,0,0,0,0,1|2,0,0]=4 50 B12R0.268 O=C(O)CCCCCCCC(=O)O Z57127532 [1,0,0,0,0,1|1,0,0]=3