0 B11R0.30 CC(=O)CCCCCCC(=O)C Z1198162235 [0,0,0,0,0,0|2,0,2]=4 1 B11R0.30 CC(=O)CCCCCCC(=O)O Z1262510893 [0,0,0,0,0,0|1,0,2]=3 2 B11R0.30 CC(=O)NCCCCCC(=O)O Z56914861 [0,0,0,0,0,0|2,0,2]=4 3 B11R0.30 NC(=O)NCCCCCC(=O)O Z90122369 [0,0,0,0,0,0|2,0,2]=4 4 B11R0.30 O=C(O)CCCCCCC(=O)O Z104473456 [0,0,0,0,0,0|0,0,2]=2 5 B11R0.30 O=C(O)COCCOCC(=O)O Z104477844 [0,0,0,0,0,0|2,0,2]=4 6 B12R0.44 O=C(O)CCNC(=O)CCC(=O)O Z608592822 [0,1,0,0,0,0|1,0,0]=2 7 B12R1.226 O=C(O)CCC1=CC(=CC=C1)O Z317038038 [0,0,0,1,0,0|1,0,2]=4 8 B12R1.226 O=C(O)CCC1=CC(=CN=C1)O Z1504676734 [0,0,0,1,0,0|2,0,1]=4 9 B12R1.226 O=C(O)CCC1CCCC(=O)N1 Z1262514420 [0,0,0,1,0,0|1,0,2]=4 10 B12R1.261 NC(=O)[C@@H]1CCCC[C@@H]1C(=O)O Z1955831204 [0,0,0,1,0,0|1,0,2]=4 11 B12R1.261 O=C(O)C1CCCNC1C(=O)O Z4868649122 [0,0,0,1,0,0|1,0,2]=4 12 B12R1.261 O=C(O)C1CCNCC1C(=O)O Z1655104197 [0,0,0,1,0,0|1,0,1]=3 13 B12R1.392 O=C(O)CN1CCCC1C(=O)O Z2694339170 [0,0,0,1,0,0|1,0,2]=4 14 B12R1.874 O=C(O)CC1CCCCC(=O)N1 Z1262554304 [0,0,0,1,0,0|1,0,2]=4 15 B12R1.1011 O=C1CCCCCC(C1)C(=O)O Z1262523591 [0,0,0,1,0,0|1,0,2]=4 16 B10R0.97 NC(=O)NCCCCC(=O)O Z90663560 [0,0,0,0,1,0|2,0,1]=4 17 B10R0.97 O=C(O)CCCCCC(=O)O Z104495338 [0,0,0,0,1,0|0,0,1]=2 18 B10R0.97 O=C(O)CCSCCC(=O)O Z104476280 [0,0,0,0,1,0|1,0,0]=2 19 B10R0.97 O=C(O)CSCSCC(=O)O Z56759247 [0,0,0,0,1,0|2,0,1]=4 20 B12R0.268 O=C(O)CCCCCCCC(=O)O Z57127532 [0,0,0,0,0,1|0,0,2]=3 21 B9R0.2 O=C(O)CCNCCCO Z53116999 [2,0,0,0,0,0|1,0,1]=4 22 B11R0.29 CC(=O)C(C)CCCCC(=O)O Z1262513809 [0,1,0,0,1,0|1,0,1]=4 23 B11R0.85 CN(CCC(=O)O)CCC(=O)O Z1459937563 [0,1,0,0,1,0|1,0,0]=3 24 B11R0.85 O=C(O)CCC(=O)NCC(=O)O Z608592516 [0,1,0,0,1,0|1,0,0]=3 25 B11R0.85 O=C(O)CCS(=O)CCC(=O)O Z1198160459 [0,1,0,0,1,0|1,0,0]=3 26 B13R0.182 CC(=O)NCCNC(=O)CCC(=O)O Z431593576 [0,1,0,0,0,1|2,0,0]=4 27 B13R0.1398 NC(CCCC(=O)O)CCCC(=O)O Z3246317628 [0,1,0,0,0,1|0,0,2]=4 28 B13R0.1398 O=C(O)CCCC(=O)CCCC(=O)O Z1269148152 [0,1,0,0,0,1|0,0,1]=3 29 B13R0.353 NC(CSSCC(N)C(=O)O)C(=O)O Z56346947 [0,2,0,0,0,0|2,0,0]=4 30 B13R0.353 N[C@@H](CSSC[C@H](N)C(=O)O)C(=O)O Z1269145231 [0,2,0,0,0,0|2,0,0]=4 31 B13R0.353 N[C@H](CSSC[C@@H](N)C(=O)O)C(=O)O Z1269180278 [0,2,0,0,0,0|2,0,0]=4 32 B11R1.90 O=C(O)CCN1CCCC1=O Z240085326 [1,0,0,1,0,0|1,0,1]=4 33 B11R1.75 CC1=CC=C(O1)CCC(=O)O Z57248456 [0,0,0,1,1,0|1,0,1]=4 34 B11R1.75 CC1=NC=C(O1)CCC(=O)O Z1255392347 [0,0,0,1,1,0|2,0,0]=4 35 B11R1.75 O=C(O)CCC1=CNC(=O)N1 Z1262517531 [0,0,0,1,1,0|2,0,0]=4 36 B11R1.75 O=C(O)CCC1CCC(=O)N1 Z1198163513 [0,0,0,1,1,0|1,0,1]=4 37 B11R1.157 O=C(O)CC1CCCC(=O)C1 Z907709938 [0,0,0,1,1,0|1,0,1]=4 38 B11R1.157 O=C(O)CC1CCCC(=O)N1 Z1255458725 [0,0,0,1,1,0|1,0,1]=4 39 B11R1.178 O=C(O)C1CCCC1C(=O)O Z1198150630 [0,0,0,1,1,0|0,0,1]=3 40 B11R1.178 O=C(O)C1COCC1C(=O)O Z1262521635 [0,0,0,1,1,0|1,0,0]=3 41 B11R1.178 O=C(O)[C@@H]1CNC[C@H]1C(=O)O Z2307407859 [0,0,0,1,1,0|1,0,0]=3 42 B11R1.497 O=C1CCCCC(N1)C(=O)O Z1217989816 [0,0,0,1,1,0|1,0,1]=4 43 B13R1.165 CC1=CCC(C(C1)C(=O)O)C(=O)O Z57157168 [0,1,0,1,0,0|0,0,0]=2 44 B13R1.547 COC(=O)C1CCNCC1C(=O)O Z3462229335 [0,1,0,1,0,0|1,0,1]=4 45 B13R1.547 COC(=O)C1CNCCC1C(=O)O Z3476971365 [0,1,0,1,0,0|1,0,1]=4 46 B13R1.547 COC(=O)[C@@H]1CCCC[C@@H]1C(=O)O Z1955918666 [0,1,0,1,0,0|0,0,2]=4 47 B13R1.547 COC(=O)[C@@H]1CNCC[C@@H]1C(=O)O Z5118494950 [0,1,0,1,0,0|1,0,1]=4 48 B9R0.55 NC(=O)CCCCC(=O)O Z429601664 [0,0,0,0,2,0|1,0,0]=3 49 B9R0.55 NC(=O)CSCCC(=O)O Z17834964 [0,0,0,0,2,0|2,0,0]=4 50 B9R0.55 NC(=O)NCCCC(=O)O Z56912008 [0,0,0,0,2,0|2,0,0]=4 51 B9R0.55 O=C(O)CCCCC(=O)O Z57127533 [0,0,0,0,2,0|0,0,0]=2 52 B13R0.179 O=C(O)CCCCCCCCC(=O)O Z104475420 [0,0,0,0,0,2|0,0,2]=4