0 B12R0.1 CCCC(=O)NCCCCCCO WXVL_AK0751SB0073 [0,1,0,0,0,0|1,0,1]=3 1 B12R0.1 CCCC(=O)NCCCCCCO WXVL_AK0751SB0073 [0,1,0,0,0,0|1,0,1]=3 2 B12R0.1 CCCCCCCCC(=O)NCC WXVL_AK00476SB0409 [0,1,0,0,0,0|2,0,1]=4 3 B12R0.1 CCCCCCCCC(=O)NCC WXVL_AK00476SB0409 [0,1,0,0,0,0|2,0,1]=4 4 B12R0.1 CCNC(=O)CCCCCCCBr WXVL_AK00476SB0559 [0,1,0,0,0,0|2,0,1]=4 5 B12R0.1 CCNC(=O)CCCCCCCBr WXVL_AK00476SB0559 [0,1,0,0,0,0|2,0,1]=4 6 B12R0.1 CCNC(=O)CCCCCCCO WXVL_AK00476SB1306 [0,1,0,0,0,0|1,0,1]=3 7 B12R0.1 CCNC(=O)CCCCCCCO WXVL_AK00476SB1306 [0,1,0,0,0,0|1,0,1]=3 8 B12R0.1 COCC(=O)NCCCCCCO WXVL_AK0751SB0090 [0,1,0,0,0,0|2,0,1]=4 9 B12R0.1 COCC(=O)NCCCCCCO WXVL_AK0751SB0090 [0,1,0,0,0,0|2,0,1]=4 10 B12R0.1 CSCC(=O)NCCCCCCO WXVL_AK0751SB1267 [0,1,0,0,0,0|2,0,1]=4 11 B12R0.1 CSCC(=O)NCCCCCCO WXVL_AK0751SB1267 [0,1,0,0,0,0|2,0,1]=4 12 B12R0.47 CCCCCNC(=O)CCCCBr WXVL_AK0076SB3153 [0,1,0,0,0,0|2,0,1]=4 13 B12R0.47 CCCCCNC(=O)CCCCBr WXVL_AK0076SB3153 [0,1,0,0,0,0|2,0,1]=4 14 B12R0.47 CCCCCNC(=O)CCCCCl WXVL_AK0076SB0379 [0,1,0,0,0,0|2,0,1]=4 15 B12R0.47 CCCCCNC(=O)CCCCCl WXVL_AK0076SB0379 [0,1,0,0,0,0|2,0,1]=4 16 B12R0.47 CCCCNC(=O)CCCCCBr WXVL_AK00588SB2192 [0,1,0,0,0,0|2,0,1]=4 17 B12R0.47 CCCCNC(=O)CCCCCBr WXVL_AK00588SB2192 [0,1,0,0,0,0|2,0,1]=4 18 B12R0.47 CCCCNC(=O)CCCCCO WXVL_AK00588SB2973 [0,1,0,0,0,0|1,0,1]=3 19 B12R0.47 CCCCNC(=O)CCCCCO WXVL_AK00588SB2973 [0,1,0,0,0,0|1,0,1]=3 20 B12R0.47 CSCCNC(=O)CCCCCO WXVL_AK00440SB2973 [0,1,0,0,0,0|2,0,1]=4 21 B12R0.47 CSCCNC(=O)CCCCCO WXVL_AK00440SB2973 [0,1,0,0,0,0|2,0,1]=4 22 B12R0.47 O=C(CCCCBr)NCCCCO WXVL_AK0075SB3153 [0,1,0,0,0,0|2,0,1]=4 23 B12R0.47 O=C(CCCCBr)NCCCCO WXVL_AK0075SB3153 [0,1,0,0,0,0|2,0,1]=4 24 B12R0.47 O=C(CCCCCBr)NCCCO WXVL_AK0073SB2192 [0,1,0,0,0,0|2,0,1]=4 25 B12R0.47 O=C(CCCCCBr)NCCCO WXVL_AK0073SB2192 [0,1,0,0,0,0|2,0,1]=4 26 B12R0.47 O=C(CCCCCO)NCCCO WXVL_AK0073SB2973 [0,1,0,0,0,0|2,0,1]=4 27 B12R0.47 O=C(CCCCCO)NCCCO WXVL_AK0073SB2973 [0,1,0,0,0,0|2,0,1]=4 28 B12R0.47 O=C(CCCCCl)NCCCCO WXVL_AK0075SB0379 [0,1,0,0,0,0|2,0,1]=4 29 B12R0.47 O=C(CCCCCl)NCCCCO WXVL_AK0075SB0379 [0,1,0,0,0,0|2,0,1]=4 30 B12R0.206 CCCCCCCC(=O)NCCC WXVL_AK00504SB0393 [0,1,0,0,0,0|2,0,1]=4 31 B12R0.206 CCCCCCCC(=O)NCCC WXVL_AK00504SB0393 [0,1,0,0,0,0|2,0,1]=4 32 B12R0.206 CCCCCCCC(=O)NCCF WXVL_AK00466SB0393 [0,1,0,0,0,0|2,0,1]=4 33 B12R0.206 CCCCCCCC(=O)NCCF WXVL_AK00466SB0393 [0,1,0,0,0,0|2,0,1]=4 34 B12R0.206 CCCNC(=O)CCCCCCBr WXVL_AK00504SB1386 [0,1,0,0,0,0|2,0,1]=4 35 B12R0.206 CCCNC(=O)CCCCCCBr WXVL_AK00504SB1386 [0,1,0,0,0,0|2,0,1]=4 36 B12R0.206 CCOCC(=O)NCCCCCO WXVL_AK0077SB0091 [0,1,0,0,0,0|2,0,1]=4 37 B12R0.206 CCOCC(=O)NCCCCCO WXVL_AK0077SB0091 [0,1,0,0,0,0|2,0,1]=4 38 B12R0.206 CCSCC(=O)NCCCCCO WXVL_AK0077SB0002 [0,1,0,0,0,0|2,0,1]=4 39 B12R0.206 CCSCC(=O)NCCCCCO WXVL_AK0077SB0002 [0,1,0,0,0,0|2,0,1]=4 40 B12R0.206 COCCC(=O)NCCCCCO WXVL_AK0077SB0156 [0,1,0,0,0,0|2,0,1]=4 41 B12R0.206 COCCC(=O)NCCCCCO WXVL_AK0077SB0156 [0,1,0,0,0,0|2,0,1]=4 42 B12R0.206 CSCCC(=O)NCCCCCO WXVL_AK0077SB0361 [0,1,0,0,0,0|2,0,1]=4 43 B12R0.206 CSCCC(=O)NCCCCCO WXVL_AK0077SB0361 [0,1,0,0,0,0|2,0,1]=4 44 B12R0.234 CC(=O)NCCCCCCCCO WXVL_AK4142SB0150 [0,1,0,0,0,0|1,0,1]=3 45 B12R0.234 CC(=O)NCCCCCCCCO WXVL_AK4142SB0150 [0,1,0,0,0,0|1,0,1]=3 46 B12R0.234 CCCCCCCCCCC(=O)N WXVL_AK0084SB0490 [0,1,0,0,0,0|0,0,2]=3 47 B12R0.234 CCCCCCCCCCC(=O)N WXVL_AK0084SB0490 [0,1,0,0,0,0|0,0,2]=3 48 B12R0.234 CCCCCCCCCNC(=O)C WXVL_AK1826SB0150 [0,1,0,0,0,0|1,0,2]=4 49 B12R0.234 CCCCCCCCCNC(=O)C WXVL_AK1826SB0150 [0,1,0,0,0,0|1,0,2]=4 50 B12R0.248 CCCCCCCCCC(=O)NC WXVL_AK00442SB0447 [0,1,0,0,0,0|2,0,1]=4 51 B12R0.248 CCCCCCCCCC(=O)NC WXVL_AK00442SB0447 [0,1,0,0,0,0|2,0,1]=4 52 B12R0.248 CCCCCCCCNC(=O)CC WXVL_AK1818SB0064 [0,1,0,0,0,0|2,0,1]=4 53 B12R0.248 CCCCCCCCNC(=O)CC WXVL_AK1818SB0064 [0,1,0,0,0,0|2,0,1]=4 54 B12R0.248 CCCCCCCCNC(=O)CO WXVL_AK1818SB2706 [0,1,0,0,0,0|1,0,1]=3 55 B12R0.248 CCCCCCCCNC(=O)CO WXVL_AK1818SB2706 [0,1,0,0,0,0|1,0,1]=3 56 B12R0.248 CCCCOCCCNC(=O)CO WXVL_AK2310SB2706 [0,1,0,0,0,0|2,0,1]=4 57 B12R0.248 CCCCOCCCNC(=O)CO WXVL_AK2310SB2706 [0,1,0,0,0,0|2,0,1]=4 58 B11R0.4 CCCC(=O)NCCCCCO WXVL_AK0077SB0073 [1,1,0,0,0,0|1,0,1]=4 59 B11R0.4 CCCC(=O)NCCCCCO WXVL_AK0077SB0073 [1,1,0,0,0,0|1,0,1]=4 60 B11R0.4 CCCCCCCC(=O)NCC WXVL_AK00476SB0393 [1,1,0,0,0,0|1,0,1]=4 61 B11R0.4 CCCCCCCC(=O)NCC WXVL_AK00476SB0393 [1,1,0,0,0,0|1,0,1]=4 62 B11R0.4 CCCCCCNC(=O)CCC WXVL_AK0286SB0073 [1,1,0,0,0,0|1,0,1]=4 63 B11R0.4 CCCCCCNC(=O)CCC WXVL_AK0286SB0073 [1,1,0,0,0,0|1,0,1]=4 64 B11R0.40 CCC(=O)NCCCCCCO WXVL_AK0751SB0064 [1,1,0,0,0,0|1,0,1]=4 65 B11R0.40 CCC(=O)NCCCCCCO WXVL_AK0751SB0064 [1,1,0,0,0,0|1,0,1]=4 66 B11R0.40 CCCCCCCCC(=O)NC WXVL_AK00442SB0409 [1,1,0,0,0,0|1,0,1]=4 67 B11R0.40 CCCCCCCCC(=O)NC WXVL_AK00442SB0409 [1,1,0,0,0,0|1,0,1]=4 68 B11R0.40 CNC(=O)CCCCCCCO WXVL_AK00442SB1306 [1,1,0,0,0,0|1,0,1]=4 69 B11R0.40 CNC(=O)CCCCCCCO WXVL_AK00442SB1306 [1,1,0,0,0,0|1,0,1]=4 70 B11R0.81 CCCNC(=O)CCCCCO WXVL_AK00504SB2973 [1,1,0,0,0,0|1,0,1]=4 71 B11R0.81 CCCNC(=O)CCCCCO WXVL_AK00504SB2973 [1,1,0,0,0,0|1,0,1]=4 72 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [1,1,0,0,0,0|0,0,2]=4 73 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [1,1,0,0,0,0|0,0,2]=4 74 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [1,1,0,0,0,0|1,0,1]=4 75 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [1,1,0,0,0,0|1,0,1]=4 76 B13R0.2 CCCCCCCCCC(=O)NCC WXVL_AK00476SB0447 [0,2,0,0,0,0|1,0,1]=4 77 B13R0.2 CCCCCCCCCC(=O)NCC WXVL_AK00476SB0447 [0,2,0,0,0,0|1,0,1]=4 78 B13R0.2 CCCCCCCCNC(=O)CCC WXVL_AK1818SB0073 [0,2,0,0,0,0|1,0,1]=4 79 B13R0.2 CCCCCCCCNC(=O)CCC WXVL_AK1818SB0073 [0,2,0,0,0,0|1,0,1]=4 80 B13R0.2 CCCCCCCCNC(=O)COC WXVL_AK1818SB0090 [0,2,0,0,0,0|1,0,1]=4 81 B13R0.2 CCCCCCCCNC(=O)COC WXVL_AK1818SB0090 [0,2,0,0,0,0|1,0,1]=4 82 B13R0.66 CCCCCCCCC(=O)NCCC WXVL_AK00504SB0409 [0,2,0,0,0,0|1,0,1]=4 83 B13R0.66 CCCCCCCCC(=O)NCCC WXVL_AK00504SB0409 [0,2,0,0,0,0|1,0,1]=4 84 B13R0.66 CCCCCCCCC(=O)NCCF WXVL_AK00466SB0409 [0,2,0,0,0,0|1,0,1]=4 85 B13R0.66 CCCCCCCCC(=O)NCCF WXVL_AK00466SB0409 [0,2,0,0,0,0|1,0,1]=4 86 B13R0.66 CCCNC(=O)CCCCCCCBr WXVL_AK00504SB0559 [0,2,0,0,0,0|1,0,1]=4 87 B13R0.66 CCCNC(=O)CCCCCCCBr WXVL_AK00504SB0559 [0,2,0,0,0,0|1,0,1]=4 88 B13R0.66 CCCNC(=O)CCCCCCCO WXVL_AK00504SB1306 [0,2,0,0,0,0|0,0,1]=3 89 B13R0.66 CCCNC(=O)CCCCCCCO WXVL_AK00504SB1306 [0,2,0,0,0,0|0,0,1]=3 90 B13R0.66 CCOCC(=O)NCCCCCCO WXVL_AK0751SB0091 [0,2,0,0,0,0|1,0,1]=4 91 B13R0.66 CCOCC(=O)NCCCCCCO WXVL_AK0751SB0091 [0,2,0,0,0,0|1,0,1]=4 92 B13R0.66 CCSCC(=O)NCCCCCCO WXVL_AK0751SB0002 [0,2,0,0,0,0|1,0,1]=4 93 B13R0.66 CCSCC(=O)NCCCCCCO WXVL_AK0751SB0002 [0,2,0,0,0,0|1,0,1]=4 94 B13R0.66 COCCC(=O)NCCCCCCO WXVL_AK0751SB0156 [0,2,0,0,0,0|1,0,1]=4 95 B13R0.66 COCCC(=O)NCCCCCCO WXVL_AK0751SB0156 [0,2,0,0,0,0|1,0,1]=4 96 B13R0.66 CSCCC(=O)NCCCCCCO WXVL_AK0751SB0361 [0,2,0,0,0,0|1,0,1]=4 97 B13R0.66 CSCCC(=O)NCCCCCCO WXVL_AK0751SB0361 [0,2,0,0,0,0|1,0,1]=4 98 B13R0.66 O=C(CCCCCCCO)NCCF WXVL_AK00466SB1306 [0,2,0,0,0,0|1,0,1]=4 99 B13R0.66 O=C(CCCCCCCO)NCCF WXVL_AK00466SB1306 [0,2,0,0,0,0|1,0,1]=4 100 B13R0.275 CCCC(C)C(=O)NCCCCCO WXVL_AK0077SB0352 [0,2,0,0,0,0|1,0,1]=4 101 B13R0.275 CCCC(C)C(=O)NCCCCCO WXVL_AK0077SB0352 [0,2,0,0,0,0|1,0,1]=4 102 B13R0.275 CCCCCCCC(=O)N(C)CCO WXVL_AN2670SB0393 [0,2,0,0,0,0|1,0,1]=4 103 B13R0.275 CCCCCCCC(=O)N(C)CCO WXVL_AN2670SB0393 [0,2,0,0,0,0|1,0,1]=4 104 B13R0.275 CCC[C@H](O)C(=O)NCCCCCO WXVL_AK0077SB3627 [0,2,0,0,0,0|1,0,1]=4 105 B13R0.275 CCC[C@H](O)C(=O)NCCCCCO WXVL_AK0077SB3627 [0,2,0,0,0,0|1,0,1]=4 106 B13R0.330 CCC[C@H](C)NC(=O)CCCCCO WXVL_AK00682SB2973 [0,2,0,0,0,0|1,0,1]=4 107 B13R0.330 CCC[C@H](C)NC(=O)CCCCCO WXVL_AK00682SB2973 [0,2,0,0,0,0|1,0,1]=4 108 B13R0.335 CC(C)CC(=O)NCCCCCCO WXVL_AK0751SB0063 [0,2,0,0,0,0|1,0,1]=4 109 B13R0.335 CC(C)CC(=O)NCCCCCCO WXVL_AK0751SB0063 [0,2,0,0,0,0|1,0,1]=4 110 B13R0.335 CC(C)NC(=O)CCCCCCCO WXVL_AK0030SB1306 [0,2,0,0,0,0|1,0,1]=4 111 B13R0.335 CC(C)NC(=O)CCCCCCCO WXVL_AK0030SB1306 [0,2,0,0,0,0|1,0,1]=4 112 B13R0.335 CC(O)CC(=O)NCCCCCCO WXVL_AK0751SB3643 [0,2,0,0,0,0|1,0,1]=4 113 B13R0.335 CC(O)CC(=O)NCCCCCCO WXVL_AK0751SB3643 [0,2,0,0,0,0|1,0,1]=4 114 B13R0.340 CCC(C)C(=O)NCCCCCCO WXVL_AK0751SB0054 [0,2,0,0,0,0|1,0,1]=4 115 B13R0.340 CCC(C)C(=O)NCCCCCCO WXVL_AK0751SB0054 [0,2,0,0,0,0|1,0,1]=4 116 B13R0.340 CC[C@@H](C)C(=O)NCCCCCCO WXVL_AK0751SB00054 [0,2,0,0,0,0|1,0,1]=4 117 B13R0.340 CC[C@@H](C)C(=O)NCCCCCCO WXVL_AK0751SB00054 [0,2,0,0,0,0|1,0,1]=4 118 B13R0.340 CC[C@H](O)C(=O)NCCCCCCO WXVL_AK0751SB3573 [0,2,0,0,0,0|1,0,1]=4 119 B13R0.340 CC[C@H](O)C(=O)NCCCCCCO WXVL_AK0751SB3573 [0,2,0,0,0,0|1,0,1]=4 120 B13R0.1338 CCCS(=O)(=O)NCCCCCCO WXVL_AK0751HU0030 [0,2,0,0,0,0|2,0,0]=4 121 B13R0.1338 CCCS(=O)(=O)NCCCCCCO WXVL_AK0751HU0030 [0,2,0,0,0,0|2,0,0]=4 122 B13R0.54 CCCCCCCCCCCC(=O)N WXVL_AK0084SB2796 [0,2,0,0,0,0|0,0,1]=3 123 B13R0.54 CCCCCCCCCCCC(=O)N WXVL_AK0084SB2796 [0,2,0,0,0,0|0,0,1]=3 124 B13R0.54 CCCCCCCCCCNC(=O)C WXVL_AK1845SB0150 [0,2,0,0,0,0|0,0,2]=4 125 B13R0.54 CCCCCCCCCCNC(=O)C WXVL_AK1845SB0150 [0,2,0,0,0,0|0,0,2]=4 126 B13R0.147 CCC(=O)NCCCCCCCCO WXVL_AK4142SB0064 [0,2,0,0,0,0|0,0,1]=3 127 B13R0.147 CCC(=O)NCCCCCCCCO WXVL_AK4142SB0064 [0,2,0,0,0,0|0,0,1]=3 128 B13R0.147 CCCCCCCCCCC(=O)NC WXVL_AK00442SB0490 [0,2,0,0,0,0|0,0,2]=4 129 B13R0.147 CCCCCCCCCCC(=O)NC WXVL_AK00442SB0490 [0,2,0,0,0,0|0,0,2]=4 130 B13R0.147 CCCCCCCCCNC(=O)CC WXVL_AK1826SB0064 [0,2,0,0,0,0|1,0,1]=4 131 B13R0.147 CCCCCCCCCNC(=O)CC WXVL_AK1826SB0064 [0,2,0,0,0,0|1,0,1]=4 132 B13R0.147 CCCCCCCCCNC(=O)CO WXVL_AK1826SB2706 [0,2,0,0,0,0|0,0,1]=3 133 B13R0.147 CCCCCCCCCNC(=O)CO WXVL_AK1826SB2706 [0,2,0,0,0,0|0,0,1]=3 134 B13R0.147 O=C(CO)NCCCCCCCCO WXVL_AK4142SB2706 [0,2,0,0,0,0|1,0,1]=4 135 B13R0.147 O=C(CO)NCCCCCCCCO WXVL_AK4142SB2706 [0,2,0,0,0,0|1,0,1]=4 136 B13R0.165 CCCCCNC(=O)CCCCCBr WXVL_AK0076SB2192 [0,2,0,0,0,0|1,0,1]=4 137 B13R0.165 CCCCCNC(=O)CCCCCBr WXVL_AK0076SB2192 [0,2,0,0,0,0|1,0,1]=4 138 B13R0.165 CCCCCNC(=O)CCCCCO WXVL_AK0076SB2973 [0,2,0,0,0,0|0,0,1]=3 139 B13R0.165 CCCCCNC(=O)CCCCCO WXVL_AK0076SB2973 [0,2,0,0,0,0|0,0,1]=3 140 B13R0.165 CCSCCNC(=O)CCCCCO WXVL_AK00494SB2973 [0,2,0,0,0,0|1,0,1]=4 141 B13R0.165 CCSCCNC(=O)CCCCCO WXVL_AK00494SB2973 [0,2,0,0,0,0|1,0,1]=4 142 B13R0.165 COCCCNC(=O)CCCCCO WXVL_AK00637SB2973 [0,2,0,0,0,0|1,0,1]=4 143 B13R0.165 COCCCNC(=O)CCCCCO WXVL_AK00637SB2973 [0,2,0,0,0,0|1,0,1]=4 144 B13R0.165 CSCCCNC(=O)CCCCCO WXVL_AK0965SB2973 [0,2,0,0,0,0|1,0,1]=4 145 B13R0.165 CSCCCNC(=O)CCCCCO WXVL_AK0965SB2973 [0,2,0,0,0,0|1,0,1]=4 146 B13R0.165 O=C(CCCCCBr)NCCCCO WXVL_AK0075SB2192 [0,2,0,0,0,0|1,0,1]=4 147 B13R0.165 O=C(CCCCCBr)NCCCCO WXVL_AK0075SB2192 [0,2,0,0,0,0|1,0,1]=4 148 B13R0.165 O=C(CCCCCO)NCCCCO WXVL_AK0075SB2973 [0,2,0,0,0,0|1,0,1]=4 149 B13R0.165 O=C(CCCCCO)NCCCCO WXVL_AK0075SB2973 [0,2,0,0,0,0|1,0,1]=4 150 B13R0.338 CCCCCCCC(=O)NCCCC WXVL_AK00588SB0393 [0,2,0,0,0,0|1,0,1]=4 151 B13R0.338 CCCCCCCC(=O)NCCCC WXVL_AK00588SB0393 [0,2,0,0,0,0|1,0,1]=4 152 B13R0.338 CCCCCCCC(=O)NCCCO WXVL_AK0073SB0393 [0,2,0,0,0,0|0,0,1]=3 153 B13R0.338 CCCCCCCC(=O)NCCCO WXVL_AK0073SB0393 [0,2,0,0,0,0|0,0,1]=3 154 B13R0.338 CCCCCCNC(=O)CCCCBr WXVL_AK0286SB3153 [0,2,0,0,0,0|1,0,1]=4 155 B13R0.338 CCCCCCNC(=O)CCCCBr WXVL_AK0286SB3153 [0,2,0,0,0,0|1,0,1]=4 156 B13R0.338 CCCCCCNC(=O)CCCCCl WXVL_AK0286SB0379 [0,2,0,0,0,0|1,0,1]=4 157 B13R0.338 CCCCCCNC(=O)CCCCCl WXVL_AK0286SB0379 [0,2,0,0,0,0|1,0,1]=4 158 B13R0.338 CCCCNC(=O)CCCCCCBr WXVL_AK00588SB1386 [0,2,0,0,0,0|1,0,1]=4 159 B13R0.338 CCCCNC(=O)CCCCCCBr WXVL_AK00588SB1386 [0,2,0,0,0,0|1,0,1]=4 160 B13R0.338 O=C(CCCCBr)NCCCCCO WXVL_AK0077SB3153 [0,2,0,0,0,0|1,0,1]=4 161 B13R0.338 O=C(CCCCBr)NCCCCCO WXVL_AK0077SB3153 [0,2,0,0,0,0|1,0,1]=4 162 B13R0.338 O=C(CCCCCCBr)NCCCO WXVL_AK0073SB1386 [0,2,0,0,0,0|1,0,1]=4 163 B13R0.338 O=C(CCCCCCBr)NCCCO WXVL_AK0073SB1386 [0,2,0,0,0,0|1,0,1]=4 164 B13R0.338 O=C(CCCCCl)NCCCCCO WXVL_AK0077SB0379 [0,2,0,0,0,0|1,0,1]=4 165 B13R0.338 O=C(CCCCCl)NCCCCCO WXVL_AK0077SB0379 [0,2,0,0,0,0|1,0,1]=4 166 B13R0.1 CC(C)CCCC(=O)NCCCCO WXVL_AK0075SB1301 [0,2,0,0,0,0|1,0,1]=4 167 B13R0.1 CC(C)CCCC(=O)NCCCCO WXVL_AK0075SB1301 [0,2,0,0,0,0|1,0,1]=4 168 B13R0.1 CC(C)CCNC(=O)CCCCCO WXVL_AK0068SB2973 [0,2,0,0,0,0|1,0,1]=4 169 B13R0.1 CC(C)CCNC(=O)CCCCCO WXVL_AK0068SB2973 [0,2,0,0,0,0|1,0,1]=4 170 B13R0.398 CCCCCC(C)C(=O)NCCCO WXVL_AK0073SB0394 [0,2,0,0,0,0|1,0,1]=4 171 B13R0.398 CCCCCC(C)C(=O)NCCCO WXVL_AK0073SB0394 [0,2,0,0,0,0|1,0,1]=4 172 B13R0.1171 CCCCC(O)C(=O)NCCCCO WXVL_AK0075SB3429 [0,2,0,0,0,0|1,0,1]=4 173 B13R0.1171 CCCCC(O)C(=O)NCCCCO WXVL_AK0075SB3429 [0,2,0,0,0,0|1,0,1]=4 174 B13R0.154 CC(C)CCC(=O)NCCCCCO WXVL_AK0077SB0354 [0,2,0,0,0,0|1,0,1]=4 175 B13R0.154 CC(C)CCC(=O)NCCCCCO WXVL_AK0077SB0354 [0,2,0,0,0,0|1,0,1]=4 176 B13R0.154 CCCCCCCC(=O)NCC(C)O WXVL_AK0052SB0393 [0,2,0,0,0,0|1,0,1]=4 177 B13R0.154 CCCCCCCC(=O)NCC(C)O WXVL_AK0052SB0393 [0,2,0,0,0,0|1,0,1]=4 178 B13R0.154 CCCCCCCC(=O)NC[C@H](C)O WXVL_AK0113SB0393 [0,2,0,0,0,0|1,0,1]=4 179 B13R0.154 CCCCCCCC(=O)NC[C@H](C)O WXVL_AK0113SB0393 [0,2,0,0,0,0|1,0,1]=4 180 B13R0.274 CCC(C)CC(=O)NCCCCCO WXVL_AK0077SB0353 [0,2,0,0,0,0|1,0,1]=4 181 B13R0.274 CCC(C)CC(=O)NCCCCCO WXVL_AK0077SB0353 [0,2,0,0,0,0|1,0,1]=4 182 B13R0.274 CCC(O)CC(=O)NCCCCCO WXVL_AK0077SB4092 [0,2,0,0,0,0|1,0,1]=4 183 B13R0.274 CCC(O)CC(=O)NCCCCCO WXVL_AK0077SB4092 [0,2,0,0,0,0|1,0,1]=4 184 B13R0.274 CCCCCCCC(=O)N[C@@H](C)CO WXVL_AK0109SB0393 [0,2,0,0,0,0|1,0,1]=4 185 B13R0.274 CCCCCCCC(=O)N[C@@H](C)CO WXVL_AK0109SB0393 [0,2,0,0,0,0|1,0,1]=4 186 B13R0.274 CC[C@@H](C)CC(=O)NCCCCCO WXVL_AK0077SB8650 [0,2,0,0,0,0|1,0,1]=4 187 B13R0.274 CC[C@@H](C)CC(=O)NCCCCCO WXVL_AK0077SB8650 [0,2,0,0,0,0|1,0,1]=4 188 B13R0.689 CCCCS(=O)(=O)NCCCCCO WXVL_AK0077HU0031 [0,2,0,0,0,0|2,0,0]=4 189 B13R0.689 CCCCS(=O)(=O)NCCCCCO WXVL_AK0077HU0031 [0,2,0,0,0,0|2,0,0]=4 190 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1818SB1085 [0,2,0,0,0,0|1,0,1]=4 191 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1818SB1085 [0,2,0,0,0,0|1,0,1]=4 192 B13R0.280 CCCCCCCCCCS(=O)(=O)N WXVL_AK0084HU0549 [0,2,0,0,0,0|1,0,1]=4 193 B13R0.280 CCCCCCCCCCS(=O)(=O)N WXVL_AK0084HU0549 [0,2,0,0,0,0|1,0,1]=4 194 B13R1.42 CCCC(=O)NCC1CCCCO1 WXVL_AK1232SB0073 [0,1,0,1,0,0|1,0,1]=4 195 B13R1.42 CCCC(=O)NCC1CCCCO1 WXVL_AK1232SB0073 [0,1,0,1,0,0|1,0,1]=4 196 B13R1.464 CCCC(=O)N1CCCCC1CO WXVL_AN0018SB0073 [0,1,0,1,0,0|1,0,1]=4 197 B13R1.464 CCCC(=O)N1CCCCC1CO WXVL_AN0018SB0073 [0,1,0,1,0,0|1,0,1]=4 198 B13R1.3151 O=C(NCCCCCCO)C1CC1 WXVL_AK0751SB0038 [0,1,0,1,0,0|1,0,1]=4 199 B13R1.3151 O=C(NCCCCCCO)C1CC1 WXVL_AK0751SB0038 [0,1,0,1,0,0|1,0,1]=4 200 B13R1.24 CCCCNC(=O)C1CCCCO1 WXVL_AK00588SB0206 [0,1,0,1,0,0|1,0,1]=4 201 B13R1.24 CCCCNC(=O)C1CCCCO1 WXVL_AK00588SB0206 [0,1,0,1,0,0|1,0,1]=4 202 B13R1.24 CCCCNC(=O)[C@H]1CCCCO1 WXVL_AK00588SB00044 [0,1,0,1,0,0|1,0,1]=4 203 B13R1.24 CCCCNC(=O)[C@H]1CCCCO1 WXVL_AK00588SB00044 [0,1,0,1,0,0|1,0,1]=4 204 B13R1.24 O=C(NCCCO)C1CCCCC1 WXVL_AK0073SB0047 [0,1,0,1,0,0|1,0,1]=4 205 B13R1.24 O=C(NCCCO)C1CCCCC1 WXVL_AK0073SB0047 [0,1,0,1,0,0|1,0,1]=4 206 B13R1.48 CCCCCNC(=O)C1CCCO1 WXVL_AK0076SB1033 [0,1,0,1,0,0|1,0,1]=4 207 B13R1.48 CCCCCNC(=O)C1CCCO1 WXVL_AK0076SB1033 [0,1,0,1,0,0|1,0,1]=4 208 B13R1.48 CCCCCNC(=O)[C@H]1CCCO1 WXVL_AK0076SB00043 [0,1,0,1,0,0|1,0,1]=4 209 B13R1.48 CCCCCNC(=O)[C@H]1CCCO1 WXVL_AK0076SB00043 [0,1,0,1,0,0|1,0,1]=4 210 B13R1.48 O=C(CCCCCO)N1CCCC1 WXVL_AN0008SB2973 [0,1,0,1,0,0|1,0,1]=4 211 B13R1.48 O=C(CCCCCO)N1CCCC1 WXVL_AN0008SB2973 [0,1,0,1,0,0|1,0,1]=4 212 B13R1.48 O=C(NCCCCO)C1CCCC1 WXVL_AK0075SB0043 [0,1,0,1,0,0|1,0,1]=4 213 B13R1.48 O=C(NCCCCO)C1CCCC1 WXVL_AK0075SB0043 [0,1,0,1,0,0|1,0,1]=4 214 B13R1.156 O=C(CC1CCCC1)NCCCO WXVL_AK0073SB0044 [0,1,0,1,0,0|1,0,1]=4 215 B13R1.156 O=C(CC1CCCC1)NCCCO WXVL_AK0073SB0044 [0,1,0,1,0,0|1,0,1]=4 216 B13R1.725 CC1CCCC1C(=O)NCCCO WXVL_AK0073SB0904 [0,1,0,1,0,0|1,0,1]=4 217 B13R1.725 CC1CCCC1C(=O)NCCCO WXVL_AK0073SB0904 [0,1,0,1,0,0|1,0,1]=4 218 B13R1.728 O=C(CCC1CCC1)NCCCO WXVL_AK0073SB8784 [0,1,0,1,0,0|1,0,1]=4 219 B13R1.728 O=C(CCC1CCC1)NCCCO WXVL_AK0073SB8784 [0,1,0,1,0,0|1,0,1]=4 220 B13R1.2916 O=C(CC1CCC1)NCCCCO WXVL_AK0075SB2207 [0,1,0,1,0,0|1,0,1]=4 221 B13R1.2916 O=C(CC1CCC1)NCCCCO WXVL_AK0075SB2207 [0,1,0,1,0,0|1,0,1]=4 222 B13R1.2917 O=C(CCC1CC1)NCCCCO WXVL_AK0075SB5360 [0,1,0,1,0,0|1,0,1]=4 223 B13R1.2917 O=C(CCC1CC1)NCCCCO WXVL_AK0075SB5360 [0,1,0,1,0,0|1,0,1]=4 224 B13R1.44 CCCNC(=O)CC1CCCCO1 WXVL_AK00504SB1464 [0,1,0,1,0,0|1,0,1]=4 225 B13R1.44 CCCNC(=O)CC1CCCCO1 WXVL_AK00504SB1464 [0,1,0,1,0,0|1,0,1]=4 226 B13R1.3572 O=C(NCCCCCO)C1CCC1 WXVL_AK0077SB0042 [0,1,0,1,0,0|1,0,1]=4 227 B13R1.3572 O=C(NCCCCCO)C1CCC1 WXVL_AK0077SB0042 [0,1,0,1,0,0|1,0,1]=4 228 B13R1.3574 O=C(CC1CC1)NCCCCCO WXVL_AK0077SB0155 [0,1,0,1,0,0|1,0,1]=4 229 B13R1.3574 O=C(CC1CC1)NCCCCCO WXVL_AK0077SB0155 [0,1,0,1,0,0|1,0,1]=4 230 B13R1.6366 CC1CC1C(=O)NCCCCCO WXVL_AK0077SB0041 [0,1,0,1,0,0|1,0,1]=4 231 B13R1.6366 CC1CC1C(=O)NCCCCCO WXVL_AK0077SB0041 [0,1,0,1,0,0|1,0,1]=4 232 B13R1.382 CCC(=O)N1CCCCC1CCO WXVL_AN2918SB0064 [0,1,0,1,0,0|1,0,1]=4 233 B13R1.382 CCC(=O)N1CCCC[C@@H]1CCO WXVL_AN00657SB0064 [0,1,0,1,0,0|1,0,1]=4 234 B13R1.581 CCCCC1CCCN1C(=O)CO WXVL_AN00739SB2706 [0,1,0,1,0,0|1,0,1]=4 235 B13R1.718 O=C(CO)NCCC1CCCCC1 WXVL_AK1287SB2706 [0,1,0,1,0,0|1,0,1]=4 236 B13R1.718 O=C(CO)NCCC1CCCCC1 WXVL_AK1287SB2706 [0,1,0,1,0,0|1,0,1]=4