0 B10R0.97 CC(=O)NCSCCC(=O)O MC436047 [0,0,0,0,0,0|2,0,0]=2 1 B10R0.97 O=C(O)CCCCCC(=O)O CS19817 [0,0,0,0,0,0|1,0,0]=1 2 B9R0.2 NCCCCCCC(=O)O CS10138 [1,0,0,0,0,0|2,0,1]=4 3 B9R0.2 O=C(O)CCCCCCO CS10820 [1,0,0,0,0,0|1,0,1]=3 4 B11R0.29 CC(=O)NCSCC(N)C(=O)O MC436891 [0,1,0,0,0,0|2,0,0]=3 5 B11R0.29 CC(=O)NCSCC(N)C(=O)O MC436892 [0,1,0,0,0,0|2,0,0]=3 6 B11R0.29 CC(=O)NCSCC(N)C(N)=O MC439467 [0,1,0,0,0,0|3,0,0]=4 7 B11R0.29 NC(=O)NCCCC(N)C(=O)O CS11543 [0,1,0,0,0,0|3,0,0]=4 8 B11R0.29 NC(=O)NCCCC(N)C(=O)O MC436863 [0,1,0,0,0,0|3,0,0]=4 9 B11R0.29 NC(=O)NCCCC(N)C(=O)O MC436864 [0,1,0,0,0,0|3,0,0]=4 10 B11R0.29 NC(CCCCC(=O)O)C(=O)O MC436182 [0,1,0,0,0,0|1,0,0]=2 11 B11R0.29 NC(CSCCB(O)O)C(=O)O MC445262 [0,1,0,0,0,0|1,0,1]=3 12 B11R0.85 NC(=O)CNC(=O)CCC(=O)O MC438178 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.178 CC(=O)N1CCCC1C(=O)O MC436104 [0,0,0,1,0,0|3,0,0]=4 14 B11R1.178 CC(=O)N1CCCC1C(=O)O MC436105 [0,0,0,1,0,0|3,0,0]=4 15 B11R1.178 CC(=O)N1CCCC1C(=O)O MC436106 [0,0,0,1,0,0|3,0,0]=4 16 B11R1.178 O=C(O)C1CCCC1C(=O)O CS12030 [0,0,0,1,0,0|1,0,0]=2 17 B9R0.55 O=C(Cl)CCCCC(=O)Cl MC40434 [0,0,0,0,1,0|2,0,0]=3 18 B11R0.30 NC(=O)CCSSCCC(N)=O MC427072 [0,0,0,0,0,1|2,0,0]=3 19 B11R0.30 O=C(O)CCCCCCC(=O)O CS11964 [0,0,0,0,0,1|1,0,0]=2 20 B8R0.7 CSCCCCC(=O)O MC112374 [2,0,0,0,0,0|2,0,0]=4 21 B8R0.7 NCCCCCC(=O)O CS13381 [2,0,0,0,0,0|1,0,1]=4 22 B8R0.7 O=C(O)CCCCCBr CS18405 [2,0,0,0,0,0|1,0,1]=4 23 B10R0.96 NC(=O)CCC(N)CC(=O)O MC439303 [0,1,0,0,1,0|1,0,0]=3 24 B10R0.96 NC(CCC(=O)O)CC(=O)O MC439102 [0,1,0,0,1,0|0,0,0]=2 25 B10R0.98 NC(CCCC(=O)O)C(=O)O MC436001 [0,1,0,0,1,0|0,0,0]=2 26 B10R0.98 NC(CCCC(=O)O)C(=O)O MC436002 [0,1,0,0,1,0|0,0,0]=2 27 B10R0.98 NC(CCCC(=O)O)C(=O)O MC436003 [0,1,0,0,1,0|0,0,0]=2 28 B12R0.42 CC(=O)NCCCCC(N)C(=O)O MC437853 [0,1,0,0,0,1|2,0,0]=4 29 B12R0.42 CC(=O)NCCCCC(N)C(=O)O MC437854 [0,1,0,0,0,1|2,0,0]=4 30 B12R0.42 NC(=O)NCCCCC(N)C(=O)O CS18633 [0,1,0,0,0,1|2,0,0]=4 31 B12R0.42 NC(=O)NCCCCC(N)C(=O)O MC437760 [0,1,0,0,0,1|2,0,0]=4 32 B12R0.42 NC(CCCCCC(=O)O)C(=O)O MC436277 [0,1,0,0,0,1|1,0,0]=3 33 B12R0.42 NC(CCCCCC(=O)O)C(=O)O MC436278 [0,1,0,0,0,1|1,0,0]=3 34 B12R0.42 NC(CCCCCC(=O)O)C(=O)O MC436279 [0,1,0,0,0,1|1,0,0]=3 35 B12R0.184 COC(=O)CCCCCCC(=O)O CS11965 [0,1,0,0,0,1|1,0,0]=3 36 B12R0.627 NC(CCCC(N)C(=O)O)C(=O)O MC436938 [0,2,0,0,0,0|1,0,0]=3 37 B10R1.61 CC(=O)C1CCCCC1=O CS21211 [1,0,0,1,0,0|2,0,0]=4 38 B10R1.61 NC(=O)C1CNCCC1=O MC115539 [1,0,0,1,0,0|2,0,0]=4 39 B10R1.61 O=C(O)C1CCCCC1O CS21597 [1,0,0,1,0,0|1,0,1]=4 40 B10R1.64 O=C(O)CN1CCCC1=O CS20147 [1,0,0,1,0,0|2,0,0]=4 41 B10R1.113 O=C1CCNC(C(=O)O)C1 MC113049 [0,0,0,1,1,0|2,0,0]=4 42 B10R1.113 O=C1CCNC(C(=O)O)C1 MC445805 [0,0,0,1,1,0|2,0,0]=4 43 B10R1.113 O=C1CCNC(C(=O)O)C1 MC445809 [0,0,0,1,1,0|2,0,0]=4 44 B10R1.361 O=C(O)C1CCC1C(=O)O MC10189 [0,0,0,1,1,0|0,0,0]=2 45 B12R1.261 O=C(O)C1CC=CCC1C(=O)O CS11154 [0,0,0,1,0,1|1,0,0]=3 46 B12R1.261 O=C(O)C1CCCCC1C(=O)O CS20513 [0,0,0,1,0,1|1,0,0]=3 47 B12R1.261 O=C(O)C1CCCCC1C(=O)O MC31150 [0,0,0,1,0,1|1,0,0]=3 48 B12R1.258 O=C(O)C1CCCC(C(=O)O)C1 CS20512 [0,1,0,1,0,0|1,0,0]=3 49 B12R1.258 O=C(O)C1CCNC(C(=O)O)C1 MC115690 [0,1,0,1,0,0|2,0,0]=4 50 B12R1.850 O=C1CC(C(=O)O)C(C(=O)O)C1 MC10468 [0,1,0,1,0,0|1,0,0]=3 51 B12R1.3799 CC1(CCC(=O)O)CCC(=O)N1 MC110555 [0,1,0,1,0,0|2,0,0]=4 52 B8R0.28 NC(=O)NCCC(=O)O MC436834 [0,0,0,0,2,0|2,0,0]=4 53 B8R0.28 O=C(O)CCCC(=O)O MC20876 [0,0,0,0,2,0|0,0,0]=2 54 B8R0.28 O=C(O)COCC(O)=S MC445127 [0,0,0,0,2,0|0,2,0]=4