0 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [0,0,0,0,0,0|2,0,0]=2 1 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [0,0,0,0,0,0|2,0,0]=2 2 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [0,0,0,0,0,0|1,0,0]=1 3 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [0,0,0,0,0,0|1,0,0]=1 4 B11R0.148 CCCCOCCCNC(=O)C WXVL_AK2310SB0150 [0,0,0,0,0,0|2,0,0]=2 5 B11R0.148 CCCCOCCCNC(=O)C WXVL_AK2310SB0150 [0,0,0,0,0,0|2,0,0]=2 6 B10R0.4 CC(=O)NCCCCCCO WXVL_AK0751SB0150 [1,0,0,0,0,0|2,0,0]=3 7 B10R0.4 CC(=O)NCCCCCCO WXVL_AK0751SB0150 [1,0,0,0,0,0|2,0,0]=3 8 B10R0.4 CCCCCCCCC(=O)N WXVL_AK0084SB0409 [1,0,0,0,0,0|1,0,0]=2 9 B10R0.4 CCCCCCCCC(=O)N WXVL_AK0084SB0409 [1,0,0,0,0,0|1,0,0]=2 10 B10R0.4 CCCCOCCNC(=O)C WXVL_AK9674SB0150 [1,0,0,0,0,0|2,0,0]=3 11 B10R0.4 CCCCOCCNC(=O)C WXVL_AK9674SB0150 [1,0,0,0,0,0|2,0,0]=3 12 B10R0.4 COCCOCCNC(=O)C WXVL_AK2206SB0150 [1,0,0,0,0,0|3,0,0]=4 13 B10R0.4 COCCOCCNC(=O)C WXVL_AK2206SB0150 [1,0,0,0,0,0|3,0,0]=4 14 B10R0.4 NC(=O)CCCCCCCBr WXVL_AK0084SB0559 [1,0,0,0,0,0|2,0,0]=3 15 B10R0.4 NC(=O)CCCCCCCBr WXVL_AK0084SB0559 [1,0,0,0,0,0|2,0,0]=3 16 B10R0.4 NC(=O)CCCCCCCO WXVL_AK0084SB1306 [1,0,0,0,0,0|2,0,0]=3 17 B10R0.4 NC(=O)CCCCCCCO WXVL_AK0084SB1306 [1,0,0,0,0,0|2,0,0]=3 18 B12R0.4 CCCCCCCC(O)CC(=O)N WXVL_AK0084SB4065 [0,1,0,0,0,0|2,0,0]=3 19 B12R0.4 CCCCCCCC(O)CC(=O)N WXVL_AK0084SB4065 [0,1,0,0,0,0|2,0,0]=3 20 B12R0.184 COC(=O)CCCCCNC(=O)C WXVL_AK00438SB0150 [0,1,0,0,0,0|2,0,1]=4 21 B12R0.184 COC(=O)CCCCCNC(=O)C WXVL_AK00438SB0150 [0,1,0,0,0,0|2,0,1]=4 22 B12R0.233 CCCCNC(=O)CCNC(=O)C WXVL_AK00588SB0374 [0,1,0,0,0,0|2,0,1]=4 23 B12R0.233 CCCCNC(=O)CCNC(=O)C WXVL_AK00588SB0374 [0,1,0,0,0,0|2,0,1]=4 24 B12R0.234 C=CCCCCCCCCC(=O)N WXVL_AK0084SB0481 [0,1,0,0,0,0|2,0,1]=4 25 B12R0.234 C=CCCCCCCCCC(=O)N WXVL_AK0084SB0481 [0,1,0,0,0,0|2,0,1]=4 26 B12R0.234 CC(=O)NCCCCCCCCO WXVL_AK4142SB0150 [0,1,0,0,0,0|1,0,0]=2 27 B12R0.234 CC(=O)NCCCCCCCCO WXVL_AK4142SB0150 [0,1,0,0,0,0|1,0,0]=2 28 B12R0.234 CC(=O)NCCOCCOCCO WXVL_AK1950SB0150 [0,1,0,0,0,0|3,0,0]=4 29 B12R0.234 CC(=O)NCCOCCOCCO WXVL_AK1950SB0150 [0,1,0,0,0,0|3,0,0]=4 30 B12R0.234 CCCCCCCCCCC(=O)N WXVL_AK0084SB0490 [0,1,0,0,0,0|2,0,0]=3 31 B12R0.234 CCCCCCCCCCC(=O)N WXVL_AK0084SB0490 [0,1,0,0,0,0|2,0,0]=3 32 B12R0.234 CCCCCCCCCNC(=O)C WXVL_AK1826SB0150 [0,1,0,0,0,0|1,0,0]=2 33 B12R0.234 CCCCCCCCCNC(=O)C WXVL_AK1826SB0150 [0,1,0,0,0,0|1,0,0]=2 34 B12R0.248 C#CC(=O)NCCCCCCCC WXVL_AK1818SB0338 [0,1,0,0,0,0|1,0,1]=3 35 B12R0.248 C#CC(=O)NCCCCCCCC WXVL_AK1818SB0338 [0,1,0,0,0,0|1,0,1]=3 36 B12R0.248 C#CC(=O)NCCCOCCCC WXVL_AK2310SB0338 [0,1,0,0,0,0|2,0,1]=4 37 B12R0.248 C#CC(=O)NCCCOCCCC WXVL_AK2310SB0338 [0,1,0,0,0,0|2,0,1]=4 38 B12R0.248 CCCCCCCCCC(=O)NC WXVL_AK00442SB0447 [0,1,0,0,0,0|1,0,0]=2 39 B12R0.248 CCCCCCCCCC(=O)NC WXVL_AK00442SB0447 [0,1,0,0,0,0|1,0,0]=2 40 B12R0.248 CCCCCCCCNC(=O)CC WXVL_AK1818SB0064 [0,1,0,0,0,0|1,0,0]=2 41 B12R0.248 CCCCCCCCNC(=O)CC WXVL_AK1818SB0064 [0,1,0,0,0,0|1,0,0]=2 42 B12R0.248 CCCCCCCCNC(=O)CO WXVL_AK1818SB2706 [0,1,0,0,0,0|1,0,0]=2 43 B12R0.248 CCCCCCCCNC(=O)CO WXVL_AK1818SB2706 [0,1,0,0,0,0|1,0,0]=2 44 B12R0.248 CCCCCCCCNC(=O)NC WXVL_AK00442YV0182 [0,1,0,0,0,0|1,0,0]=2 45 B12R0.248 CCCCCCCCNC(=O)NC WXVL_AK00442YV0182 [0,1,0,0,0,0|1,0,0]=2 46 B12R0.248 CCCCOCCCNC(=O)CC WXVL_AK2310SB0064 [0,1,0,0,0,0|2,0,0]=3 47 B12R0.248 CCCCOCCCNC(=O)CC WXVL_AK2310SB0064 [0,1,0,0,0,0|2,0,0]=3 48 B12R0.248 CCCCOCCCNC(=O)CO WXVL_AK2310SB2706 [0,1,0,0,0,0|2,0,0]=3 49 B12R0.248 CCCCOCCCNC(=O)CO WXVL_AK2310SB2706 [0,1,0,0,0,0|2,0,0]=3 50 B12R0.251 CC(=O)C(=O)NCCCCCCO WXVL_AK0751SB0051 [0,1,0,0,0,0|3,0,0]=4 51 B12R0.251 CC(=O)C(=O)NCCCCCCO WXVL_AK0751SB0051 [0,1,0,0,0,0|3,0,0]=4 52 B12R0.251 CCCCCCCCC(=O)N(C)C WXVL_AN0032SB0409 [0,1,0,0,0,0|3,0,0]=4 53 B12R0.251 CCCCCCCCC(=O)N(C)C WXVL_AN0032SB0409 [0,1,0,0,0,0|3,0,0]=4 54 B12R0.251 CCCCOCCNC(=O)C(=O)C WXVL_AK9674SB0051 [0,1,0,0,0,0|3,0,0]=4 55 B12R0.251 CCCCOCCNC(=O)C(=O)C WXVL_AK9674SB0051 [0,1,0,0,0,0|3,0,0]=4 56 B12R0.255 CC(=O)OCC(=O)NCCCCO WXVL_AK0075SB2824 [0,1,0,0,0,0|2,0,1]=4 57 B12R0.255 CC(=O)OCC(=O)NCCCCO WXVL_AK0075SB2824 [0,1,0,0,0,0|2,0,1]=4 58 B12R0.255 CCCCCNC(=O)CCC(=O)C WXVL_AK0076SB0072 [0,1,0,0,0,0|2,0,1]=4 59 B12R0.255 CCCCCNC(=O)CCC(=O)C WXVL_AK0076SB0072 [0,1,0,0,0,0|2,0,1]=4 60 B12R0.255 CCCCCNC(=O)CNC(=O)C WXVL_AK0076SB0357 [0,1,0,0,0,0|2,0,1]=4 61 B12R0.255 CCCCCNC(=O)CNC(=O)C WXVL_AK0076SB0357 [0,1,0,0,0,0|2,0,1]=4 62 B12R0.255 CCCCCNC(=O)COC(=O)C WXVL_AK0076SB2824 [0,1,0,0,0,0|1,0,1]=3 63 B12R0.255 CCCCCNC(=O)COC(=O)C WXVL_AK0076SB2824 [0,1,0,0,0,0|1,0,1]=3 64 B12R0.255 CCCCCNC(=O)CSC(=O)C WXVL_AK0076SB3992 [0,1,0,0,0,0|1,1,1]=4 65 B12R0.255 CCCCCNC(=O)CSC(=O)C WXVL_AK0076SB3992 [0,1,0,0,0,0|1,1,1]=4 66 B12R0.255 CCSCCNC(=O)COC(=O)C WXVL_AK00494SB2824 [0,1,0,0,0,0|2,0,1]=4 67 B12R0.255 CCSCCNC(=O)COC(=O)C WXVL_AK00494SB2824 [0,1,0,0,0,0|2,0,1]=4 68 B12R0.255 COCCCNC(=O)COC(=O)C WXVL_AK00637SB2824 [0,1,0,0,0,0|2,0,1]=4 69 B12R0.255 COCCCNC(=O)COC(=O)C WXVL_AK00637SB2824 [0,1,0,0,0,0|2,0,1]=4 70 B12R0.255 CSCCCNC(=O)COC(=O)C WXVL_AK0965SB2824 [0,1,0,0,0,0|2,0,1]=4 71 B12R0.255 CSCCCNC(=O)COC(=O)C WXVL_AK0965SB2824 [0,1,0,0,0,0|2,0,1]=4 72 B12R0.268 CC(=O)NCCCCCNC(=O)C WXVL_AK4207SB0150 [0,1,0,0,0,0|2,0,1]=4 73 B12R0.268 CC(=O)NCCCCCNC(=O)C WXVL_AK4207SB0150 [0,1,0,0,0,0|2,0,1]=4 74 B12R1.130 CC(=O)NCCC1CCCN1C WXVL_AK2343SB0150 [0,0,0,1,0,0|2,0,0]=3 75 B12R1.130 CC(=O)NCCC1CCCN1C WXVL_AK2343SB0150 [0,0,0,1,0,0|2,0,0]=3 76 B12R1.252 CC(=O)NCCC1CCCCC1 WXVL_AK1287SB0150 [0,0,0,1,0,0|1,0,0]=2 77 B12R1.252 CC(=O)NCCC1CCCCC1 WXVL_AK1287SB0150 [0,0,0,1,0,0|1,0,0]=2 78 B12R1.252 CC(=O)NCCC1CCOCC1 WXVL_AK0294SB0150 [0,0,0,1,0,0|2,0,0]=3 79 B12R1.252 CC(=O)NCCC1CCOCC1 WXVL_AK0294SB0150 [0,0,0,1,0,0|2,0,0]=3 80 B12R1.252 CC(=O)NCCN1CCCCC1 WXVL_AK0023SB0150 [0,0,0,1,0,0|2,0,0]=3 81 B12R1.252 CC(=O)NCCN1CCCCC1 WXVL_AK0023SB0150 [0,0,0,1,0,0|2,0,0]=3 82 B12R1.252 CC(=O)NCCN1CCOCC1 WXVL_AK0016SB0150 [0,0,0,1,0,0|3,0,0]=4 83 B12R1.252 CC(=O)NCCN1CCOCC1 WXVL_AK0016SB0150 [0,0,0,1,0,0|3,0,0]=4 84 B12R1.255 CC(=O)NCCCN1CCCC1 WXVL_AK0085SB0150 [0,0,0,1,0,0|2,0,0]=3 85 B12R1.255 CC(=O)NCCCN1CCCC1 WXVL_AK0085SB0150 [0,0,0,1,0,0|2,0,0]=3 86 B12R1.255 CC(=O)NCCOC1CCCC1 WXVL_AK3996SB0150 [0,0,0,1,0,0|2,0,0]=3 87 B12R1.255 CC(=O)NCCOC1CCCC1 WXVL_AK3996SB0150 [0,0,0,1,0,0|2,0,0]=3 88 B12R1.283 CC(=O)N1CCCCC1CCO WXVL_AN2918SB0150 [0,0,0,1,0,0|2,0,0]=3 89 B12R1.283 CC(=O)N1CCCC[C@@H]1CCO WXVL_AN00657SB0150 [0,0,0,1,0,0|2,0,0]=3 90 B12R1.283 COCC1CCCCN1C(=O)C WXVL_AN0507SB0150 [0,0,0,1,0,0|2,0,0]=3 91 B12R1.283 COCC1CCCCN1C(=O)C WXVL_AN0507SB0150 [0,0,0,1,0,0|2,0,0]=3 92 B12R1.283 COC[C@H]1COCCN1C(=O)C WXVL_AN00791SB0150 [0,0,0,1,0,0|3,0,0]=4 93 B12R1.386 CCCCC1CCCN1C(=O)C WXVL_AN00739SB0150 [0,0,0,1,0,0|1,0,0]=2 94 B9R0.2 CC(=O)NCCCCCO WXVL_AK0077SB0150 [2,0,0,0,0,0|2,0,0]=4 95 B9R0.2 CC(=O)NCCCCCO WXVL_AK0077SB0150 [2,0,0,0,0,0|2,0,0]=4 96 B9R0.2 CCCCCCCC(=O)N WXVL_AK0084SB0393 [2,0,0,0,0,0|1,0,0]=3 97 B9R0.2 CCCCCCCC(=O)N WXVL_AK0084SB0393 [2,0,0,0,0,0|1,0,0]=3 98 B9R0.2 CCCCCCNC(=O)C WXVL_AK0286SB0150 [2,0,0,0,0,0|1,0,0]=3 99 B9R0.2 CCCCCCNC(=O)C WXVL_AK0286SB0150 [2,0,0,0,0,0|1,0,0]=3 100 B9R0.2 CCOCCCNC(=O)C WXVL_AK0072SB0150 [2,0,0,0,0,0|2,0,0]=4 101 B9R0.2 CCOCCCNC(=O)C WXVL_AK0072SB0150 [2,0,0,0,0,0|2,0,0]=4 102 B9R0.2 NC(=O)CCCCCCBr WXVL_AK0084SB1386 [2,0,0,0,0,0|2,0,0]=4 103 B9R0.2 NC(=O)CCCCCCBr WXVL_AK0084SB1386 [2,0,0,0,0,0|2,0,0]=4 104 B11R0.30 CC(=O)NCCCCCN(C)C WXVL_AK0956SB0150 [1,1,0,0,0,0|2,0,0]=4 105 B11R0.30 CC(=O)NCCCCCN(C)C WXVL_AK0956SB0150 [1,1,0,0,0,0|2,0,0]=4 106 B11R0.40 CCC(=O)NCCCCCCO WXVL_AK0751SB0064 [1,1,0,0,0,0|2,0,0]=4 107 B11R0.40 CCC(=O)NCCCCCCO WXVL_AK0751SB0064 [1,1,0,0,0,0|2,0,0]=4 108 B11R0.40 CCCCCCCCC(=O)NC WXVL_AK00442SB0409 [1,1,0,0,0,0|0,0,0]=2 109 B11R0.40 CCCCCCCCC(=O)NC WXVL_AK00442SB0409 [1,1,0,0,0,0|0,0,0]=2 110 B11R0.40 CCCCOCCNC(=O)CC WXVL_AK9674SB0064 [1,1,0,0,0,0|2,0,0]=4 111 B11R0.40 CCCCOCCNC(=O)CC WXVL_AK9674SB0064 [1,1,0,0,0,0|2,0,0]=4 112 B11R0.40 CCCCOCCNC(=O)CO WXVL_AK9674SB2706 [1,1,0,0,0,0|2,0,0]=4 113 B11R0.40 CCCCOCCNC(=O)CO WXVL_AK9674SB2706 [1,1,0,0,0,0|2,0,0]=4 114 B11R0.40 CNC(=O)CCCCCCCBr WXVL_AK00442SB0559 [1,1,0,0,0,0|1,0,0]=3 115 B11R0.40 CNC(=O)CCCCCCCBr WXVL_AK00442SB0559 [1,1,0,0,0,0|1,0,0]=3 116 B11R0.40 CNC(=O)CCCCCCCO WXVL_AK00442SB1306 [1,1,0,0,0,0|1,0,0]=3 117 B11R0.40 CNC(=O)CCCCCCCO WXVL_AK00442SB1306 [1,1,0,0,0,0|1,0,0]=3 118 B11R0.40 O=C(CO)NCCCCCCO WXVL_AK0751SB2706 [1,1,0,0,0,0|2,0,0]=4 119 B11R0.40 O=C(CO)NCCCCCCO WXVL_AK0751SB2706 [1,1,0,0,0,0|2,0,0]=4 120 B11R0.42 CCCCCCNC(=O)C(=O)C WXVL_AK0286SB0051 [1,1,0,0,0,0|1,0,1]=4 121 B11R0.42 CCCCCCNC(=O)C(=O)C WXVL_AK0286SB0051 [1,1,0,0,0,0|1,0,1]=4 122 B11R0.46 CCCCNC(=O)CCC(=O)C WXVL_AK00588SB0072 [1,1,0,0,0,0|1,0,1]=4 123 B11R0.46 CCCCNC(=O)CCC(=O)C WXVL_AK00588SB0072 [1,1,0,0,0,0|1,0,1]=4 124 B11R0.46 CCCCNC(=O)COC(=O)C WXVL_AK00588SB2824 [1,1,0,0,0,0|1,0,1]=4 125 B11R0.46 CCCCNC(=O)COC(=O)C WXVL_AK00588SB2824 [1,1,0,0,0,0|1,0,1]=4 126 B11R0.159 CCCCCCCCS(=O)(=O)N WXVL_AK0084HU0331 [1,1,0,0,0,0|2,0,0]=4 127 B11R0.159 CCCCCCCCS(=O)(=O)N WXVL_AK0084HU0331 [1,1,0,0,0,0|2,0,0]=4 128 B13R0.274 CCCCCCCC(O)CC(=O)NC WXVL_AK00442SB4065 [0,2,0,0,0,0|1,0,0]=3 129 B13R0.274 CCCCCCCC(O)CC(=O)NC WXVL_AK00442SB4065 [0,2,0,0,0,0|1,0,0]=3 130 B13R0.1215 CCCCCCCCNS(=O)(=O)CC WXVL_AK1818HU0028 [0,2,0,0,0,0|2,0,0]=4 131 B13R0.1215 CCCCCCCCNS(=O)(=O)CC WXVL_AK1818HU0028 [0,2,0,0,0,0|2,0,0]=4 132 B13R0.1 CCCCCNC(=O)CCNC(=O)C WXVL_AK0076SB0374 [0,2,0,0,0,0|1,0,1]=4 133 B13R0.1 CCCCCNC(=O)CCNC(=O)C WXVL_AK0076SB0374 [0,2,0,0,0,0|1,0,1]=4 134 B13R0.54 CC(=O)NCCCOCCOCCO WXVL_AK9828SB0150 [0,2,0,0,0,0|2,0,0]=4 135 B13R0.54 CC(=O)NCCCOCCOCCO WXVL_AK9828SB0150 [0,2,0,0,0,0|2,0,0]=4 136 B13R0.54 CCCCCCCCCCCC(=O)N WXVL_AK0084SB2796 [0,2,0,0,0,0|2,0,0]=4 137 B13R0.54 CCCCCCCCCCCC(=O)N WXVL_AK0084SB2796 [0,2,0,0,0,0|2,0,0]=4 138 B13R0.54 CCCCCCCCCCNC(=O)C WXVL_AK1845SB0150 [0,2,0,0,0,0|1,0,0]=3 139 B13R0.54 CCCCCCCCCCNC(=O)C WXVL_AK1845SB0150 [0,2,0,0,0,0|1,0,0]=3 140 B13R0.54 COCCOCCOCCNC(=O)C WXVL_AK1800SB0150 [0,2,0,0,0,0|2,0,0]=4 141 B13R0.54 COCCOCCOCCNC(=O)C WXVL_AK1800SB0150 [0,2,0,0,0,0|2,0,0]=4 142 B13R0.147 C#CC(=O)NCCCCCCCCC WXVL_AK1826SB0338 [0,2,0,0,0,0|1,0,1]=4 143 B13R0.147 C#CC(=O)NCCCCCCCCC WXVL_AK1826SB0338 [0,2,0,0,0,0|1,0,1]=4 144 B13R0.147 C#CC(=O)NCCCCCCCCO WXVL_AK4142SB0338 [0,2,0,0,0,0|1,0,1]=4 145 B13R0.147 C#CC(=O)NCCCCCCCCO WXVL_AK4142SB0338 [0,2,0,0,0,0|1,0,1]=4 146 B13R0.147 C=CCCCCCCCCC(=O)NC WXVL_AK00442SB0481 [0,2,0,0,0,0|1,0,1]=4 147 B13R0.147 C=CCCCCCCCCC(=O)NC WXVL_AK00442SB0481 [0,2,0,0,0,0|1,0,1]=4 148 B13R0.147 CCC(=O)NCCCCCCCCO WXVL_AK4142SB0064 [0,2,0,0,0,0|1,0,0]=3 149 B13R0.147 CCC(=O)NCCCCCCCCO WXVL_AK4142SB0064 [0,2,0,0,0,0|1,0,0]=3 150 B13R0.147 CCCCCCCCCCC(=O)NC WXVL_AK00442SB0490 [0,2,0,0,0,0|1,0,0]=3 151 B13R0.147 CCCCCCCCCCC(=O)NC WXVL_AK00442SB0490 [0,2,0,0,0,0|1,0,0]=3 152 B13R0.147 CCCCCCCCCNC(=O)CC WXVL_AK1826SB0064 [0,2,0,0,0,0|1,0,0]=3 153 B13R0.147 CCCCCCCCCNC(=O)CC WXVL_AK1826SB0064 [0,2,0,0,0,0|1,0,0]=3 154 B13R0.147 CCCCCCCCCNC(=O)CO WXVL_AK1826SB2706 [0,2,0,0,0,0|1,0,0]=3 155 B13R0.147 CCCCCCCCCNC(=O)CO WXVL_AK1826SB2706 [0,2,0,0,0,0|1,0,0]=3 156 B13R0.147 O=C(CO)NCCCCCCCCO WXVL_AK4142SB2706 [0,2,0,0,0,0|1,0,0]=3 157 B13R0.147 O=C(CO)NCCCCCCCCO WXVL_AK4142SB2706 [0,2,0,0,0,0|1,0,0]=3 158 B13R0.150 C=C(F)C(=O)NCCCCCCCC WXVL_AK1818SB1376 [0,2,0,0,0,0|1,0,1]=4 159 B13R0.150 C=C(F)C(=O)NCCCCCCCC WXVL_AK1818SB1376 [0,2,0,0,0,0|1,0,1]=4 160 B13R0.150 CCCCCCCCCC(=O)N(C)C WXVL_AN0032SB0447 [0,2,0,0,0,0|1,0,0]=3 161 B13R0.150 CCCCCCCCCC(=O)N(C)C WXVL_AN0032SB0447 [0,2,0,0,0,0|1,0,0]=3 162 B13R0.150 CCCCCCCCNC(=O)C(=O)C WXVL_AK1818SB0051 [0,2,0,0,0,0|1,0,0]=3 163 B13R0.150 CCCCCCCCNC(=O)C(=O)C WXVL_AK1818SB0051 [0,2,0,0,0,0|1,0,0]=3 164 B13R0.150 CCCCCCCCNC(=O)C(=O)N WXVL_AK1818SB0128 [0,2,0,0,0,0|1,0,1]=4 165 B13R0.150 CCCCCCCCNC(=O)C(=O)N WXVL_AK1818SB0128 [0,2,0,0,0,0|1,0,1]=4 166 B13R0.150 CCCCCCCCNC(=O)C(C)C WXVL_AK1818SB0052 [0,2,0,0,0,0|1,0,0]=3 167 B13R0.150 CCCCCCCCNC(=O)C(C)C WXVL_AK1818SB0052 [0,2,0,0,0,0|1,0,0]=3 168 B13R0.150 CCCCCCCCNC(=O)C(C)S WXVL_AK1818SB2708 [0,2,0,0,0,0|1,0,0]=3 169 B13R0.150 CCCCCCCCNC(=O)C(C)S WXVL_AK1818SB2708 [0,2,0,0,0,0|1,0,0]=3 170 B13R0.150 CCCCCCCCNC(=O)C(F)F WXVL_AK1818SB0079 [0,2,0,0,0,0|1,0,0]=3 171 B13R0.150 CCCCCCCCNC(=O)C(F)F WXVL_AK1818SB0079 [0,2,0,0,0,0|1,0,0]=3 172 B13R0.150 CCCCCCCCNC(=O)N(C)C WXVL_AN0032YV0182 [0,2,0,0,0,0|1,0,0]=3 173 B13R0.150 CCCCCCCCNC(=O)N(C)C WXVL_AN0032YV0182 [0,2,0,0,0,0|1,0,0]=3 174 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1818SB1085 [0,2,0,0,0,0|1,0,0]=3 175 B13R0.150 CCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1818SB1085 [0,2,0,0,0,0|1,0,0]=3 176 B13R0.150 CCCCOCCCNC(=O)C(=O)C WXVL_AK2310SB0051 [0,2,0,0,0,0|2,0,0]=4 177 B13R0.150 CCCCOCCCNC(=O)C(=O)C WXVL_AK2310SB0051 [0,2,0,0,0,0|2,0,0]=4 178 B13R0.150 CCCCOCCCNC(=O)C(C)C WXVL_AK2310SB0052 [0,2,0,0,0,0|2,0,0]=4 179 B13R0.150 CCCCOCCCNC(=O)C(C)C WXVL_AK2310SB0052 [0,2,0,0,0,0|2,0,0]=4 180 B13R0.150 CCCCOCCCNC(=O)C(C)S WXVL_AK2310SB2708 [0,2,0,0,0,0|2,0,0]=4 181 B13R0.150 CCCCOCCCNC(=O)C(C)S WXVL_AK2310SB2708 [0,2,0,0,0,0|2,0,0]=4 182 B13R0.150 CCCCOCCCNC(=O)C(F)F WXVL_AK2310SB0079 [0,2,0,0,0,0|2,0,0]=4 183 B13R0.150 CCCCOCCCNC(=O)C(F)F WXVL_AK2310SB0079 [0,2,0,0,0,0|2,0,0]=4 184 B13R0.150 CCCCOCCCNC(=O)[C@@H](C)O WXVL_AK2310SB1085 [0,2,0,0,0,0|2,0,0]=4 185 B13R0.150 CCCCOCCCNC(=O)[C@@H](C)O WXVL_AK2310SB1085 [0,2,0,0,0,0|2,0,0]=4 186 B13R0.154 CC(=O)OCC(=O)NCCCCCO WXVL_AK0077SB2824 [0,2,0,0,0,0|1,0,1]=4 187 B13R0.154 CC(=O)OCC(=O)NCCCCCO WXVL_AK0077SB2824 [0,2,0,0,0,0|1,0,1]=4 188 B13R0.154 CCCCCCNC(=O)CCC(=O)C WXVL_AK0286SB0072 [0,2,0,0,0,0|1,0,1]=4 189 B13R0.154 CCCCCCNC(=O)CCC(=O)C WXVL_AK0286SB0072 [0,2,0,0,0,0|1,0,1]=4 190 B13R0.154 CCCCCCNC(=O)CNC(=O)C WXVL_AK0286SB0357 [0,2,0,0,0,0|1,0,1]=4 191 B13R0.154 CCCCCCNC(=O)CNC(=O)C WXVL_AK0286SB0357 [0,2,0,0,0,0|1,0,1]=4 192 B13R0.154 CCCCCCNC(=O)COC(=O)C WXVL_AK0286SB2824 [0,2,0,0,0,0|0,0,1]=3 193 B13R0.154 CCCCCCNC(=O)COC(=O)C WXVL_AK0286SB2824 [0,2,0,0,0,0|0,0,1]=3 194 B13R0.154 CCCCCCNC(=O)CSC(=O)C WXVL_AK0286SB3992 [0,2,0,0,0,0|0,1,1]=4 195 B13R0.154 CCCCCCNC(=O)CSC(=O)C WXVL_AK0286SB3992 [0,2,0,0,0,0|0,1,1]=4 196 B13R0.154 CCOCCCNC(=O)COC(=O)C WXVL_AK0072SB2824 [0,2,0,0,0,0|1,0,1]=4 197 B13R0.154 CCOCCCNC(=O)COC(=O)C WXVL_AK0072SB2824 [0,2,0,0,0,0|1,0,1]=4 198 B13R0.202 CCC(=O)NCCCCCNC(=O)C WXVL_AK4207SB0064 [0,2,0,0,0,0|1,0,1]=4 199 B13R0.202 CCC(=O)NCCCCCNC(=O)C WXVL_AK4207SB0064 [0,2,0,0,0,0|1,0,1]=4 200 B13R0.202 COC(=O)CCCCCCNC(=O)C WXVL_AK00211SB0150 [0,2,0,0,0,0|1,0,1]=4 201 B13R0.202 COC(=O)CCCCCCNC(=O)C WXVL_AK00211SB0150 [0,2,0,0,0,0|1,0,1]=4 202 B13R0.2 C#CCC(=O)NCCCCCCCC WXVL_AK1818SB3070 [0,2,0,0,0,0|1,0,0]=3 203 B13R0.2 C#CCC(=O)NCCCCCCCC WXVL_AK1818SB3070 [0,2,0,0,0,0|1,0,0]=3 204 B13R0.2 C#CCC(=O)NCCCOCCCC WXVL_AK2310SB3070 [0,2,0,0,0,0|2,0,0]=4 205 B13R0.2 C#CCC(=O)NCCCOCCCC WXVL_AK2310SB3070 [0,2,0,0,0,0|2,0,0]=4 206 B13R0.2 C/C=C/C(=O)NCCCCCCCC WXVL_AK1818SB0340 [0,2,0,0,0,0|1,0,0]=3 207 B13R0.2 C/C=C/C(=O)NCCCCCCCC WXVL_AK1818SB0340 [0,2,0,0,0,0|1,0,0]=3 208 B13R0.2 C/C=C/C(=O)NCCCOCCCC WXVL_AK2310SB0340 [0,2,0,0,0,0|2,0,0]=4 209 B13R0.2 C/C=C/C(=O)NCCCOCCCC WXVL_AK2310SB0340 [0,2,0,0,0,0|2,0,0]=4 210 B13R0.2 C=CCC(=O)NCCCCCCCC WXVL_AK1818SB2732 [0,2,0,0,0,0|1,0,0]=3 211 B13R0.2 C=CCC(=O)NCCCCCCCC WXVL_AK1818SB2732 [0,2,0,0,0,0|1,0,0]=3 212 B13R0.2 C=CCC(=O)NCCCOCCCC WXVL_AK2310SB2732 [0,2,0,0,0,0|2,0,0]=4 213 B13R0.2 C=CCC(=O)NCCCOCCCC WXVL_AK2310SB2732 [0,2,0,0,0,0|2,0,0]=4 214 B13R0.2 CC#CC(=O)NCCCCCCCC WXVL_AK1818SB1240 [0,2,0,0,0,0|1,0,0]=3 215 B13R0.2 CC#CC(=O)NCCCCCCCC WXVL_AK1818SB1240 [0,2,0,0,0,0|1,0,0]=3 216 B13R0.2 CC#CC(=O)NCCCOCCCC WXVL_AK2310SB1240 [0,2,0,0,0,0|2,0,0]=4 217 B13R0.2 CC#CC(=O)NCCCOCCCC WXVL_AK2310SB1240 [0,2,0,0,0,0|2,0,0]=4 218 B13R0.2 CCCCCCCCCC(=O)NCC WXVL_AK00476SB0447 [0,2,0,0,0,0|1,0,0]=3 219 B13R0.2 CCCCCCCCCC(=O)NCC WXVL_AK00476SB0447 [0,2,0,0,0,0|1,0,0]=3 220 B13R0.2 CCCCCCCCNC(=O)CC#N WXVL_AK1818SB0057 [0,2,0,0,0,0|1,0,0]=3 221 B13R0.2 CCCCCCCCNC(=O)CC#N WXVL_AK1818SB0057 [0,2,0,0,0,0|1,0,0]=3 222 B13R0.2 CCCCCCCCNC(=O)CCC WXVL_AK1818SB0073 [0,2,0,0,0,0|1,0,0]=3 223 B13R0.2 CCCCCCCCNC(=O)CCC WXVL_AK1818SB0073 [0,2,0,0,0,0|1,0,0]=3 224 B13R0.2 CCCCCCCCNC(=O)COC WXVL_AK1818SB0090 [0,2,0,0,0,0|1,0,0]=3 225 B13R0.2 CCCCCCCCNC(=O)COC WXVL_AK1818SB0090 [0,2,0,0,0,0|1,0,0]=3 226 B13R0.2 CCCCCCCCNC(=O)CSC WXVL_AK1818SB1267 [0,2,0,0,0,0|1,0,0]=3 227 B13R0.2 CCCCCCCCNC(=O)CSC WXVL_AK1818SB1267 [0,2,0,0,0,0|1,0,0]=3 228 B13R0.2 CCCCCCCCNC(=O)NCC WXVL_AK00476YV0182 [0,2,0,0,0,0|1,0,0]=3 229 B13R0.2 CCCCCCCCNC(=O)NCC WXVL_AK00476YV0182 [0,2,0,0,0,0|1,0,0]=3 230 B13R0.2 CCCCOCCCNC(=O)CC#N WXVL_AK2310SB0057 [0,2,0,0,0,0|2,0,0]=4 231 B13R0.2 CCCCOCCCNC(=O)CC#N WXVL_AK2310SB0057 [0,2,0,0,0,0|2,0,0]=4 232 B13R0.2 CCCCOCCCNC(=O)CCC WXVL_AK2310SB0073 [0,2,0,0,0,0|2,0,0]=4 233 B13R0.2 CCCCOCCCNC(=O)CCC WXVL_AK2310SB0073 [0,2,0,0,0,0|2,0,0]=4 234 B13R0.2 CCCCOCCCNC(=O)COC WXVL_AK2310SB0090 [0,2,0,0,0,0|2,0,0]=4 235 B13R0.2 CCCCOCCCNC(=O)COC WXVL_AK2310SB0090 [0,2,0,0,0,0|2,0,0]=4 236 B13R0.2 CCCCOCCCNC(=O)CSC WXVL_AK2310SB1267 [0,2,0,0,0,0|2,0,0]=4 237 B13R0.2 CCCCOCCCNC(=O)CSC WXVL_AK2310SB1267 [0,2,0,0,0,0|2,0,0]=4 238 B11R1.53 CC(=O)N1CCCCC1CO WXVL_AN0018SB0150 [1,0,0,1,0,0|2,0,0]=4 239 B11R1.53 CC(=O)N1CCCCC1CO WXVL_AN0018SB0150 [1,0,0,1,0,0|2,0,0]=4 240 B11R1.90 CC(=O)NC[C@@H]1CCCN1C WXVL_AK00784SB0150 [1,0,0,1,0,0|2,0,0]=4 241 B11R1.90 CC(=O)NC[C@@H]1CCCN1C WXVL_AK00784SB0150 [1,0,0,1,0,0|2,0,0]=4 242 B11R1.91 CC(=O)NCC1CCCCO1 WXVL_AK1232SB0150 [1,0,0,1,0,0|2,0,0]=4 243 B11R1.91 CC(=O)NCC1CCCCO1 WXVL_AK1232SB0150 [1,0,0,1,0,0|2,0,0]=4 244 B11R1.91 CC(=O)NCC1CCCOC1 WXVL_AK00150SB0150 [1,0,0,1,0,0|2,0,0]=4 245 B11R1.91 CC(=O)NCC1CCCOC1 WXVL_AK00150SB0150 [1,0,0,1,0,0|2,0,0]=4 246 B11R1.91 CC(=O)NCC1CCOCC1 WXVL_AK0150SB0150 [1,0,0,1,0,0|2,0,0]=4 247 B11R1.91 CC(=O)NCC1CCOCC1 WXVL_AK0150SB0150 [1,0,0,1,0,0|2,0,0]=4 248 B11R1.91 CC(=O)NCC1CCSCC1 WXVL_AK00654SB0150 [1,0,0,1,0,0|2,0,0]=4 249 B11R1.91 CC(=O)NCC1CCSCC1 WXVL_AK00654SB0150 [1,0,0,1,0,0|2,0,0]=4 250 B11R1.91 NC(=O)CCC1CCCCC1 WXVL_AK0084SB0049 [1,0,0,1,0,0|1,0,0]=3 251 B11R1.91 NC(=O)CCC1CCCCC1 WXVL_AK0084SB0049 [1,0,0,1,0,0|1,0,0]=3 252 B11R1.91 NC(=O)CCN1CCCCC1 WXVL_AK0084SB0127 [1,0,0,1,0,0|2,0,0]=4 253 B11R1.91 NC(=O)CCN1CCCCC1 WXVL_AK0084SB0127 [1,0,0,1,0,0|2,0,0]=4 254 B11R1.91 NC(=O)COC1CCCCC1 WXVL_AK0084SB3400 [1,0,0,1,0,0|2,0,0]=4 255 B11R1.91 NC(=O)COC1CCCCC1 WXVL_AK0084SB3400 [1,0,0,1,0,0|2,0,0]=4 256 B11R1.172 CC(=O)NCCC1CCCC1 WXVL_AK00531SB0150 [1,0,0,1,0,0|1,0,0]=3 257 B11R1.172 CC(=O)NCCC1CCCC1 WXVL_AK00531SB0150 [1,0,0,1,0,0|1,0,0]=3 258 B13R1.337 CC(=O)NCCCC1CCCCC1 WXVL_AK4112SB0150 [0,1,0,1,0,0|1,0,0]=3 259 B13R1.337 CC(=O)NCCCC1CCCCC1 WXVL_AK4112SB0150 [0,1,0,1,0,0|1,0,0]=3 260 B13R1.337 CC(=O)NCCCN1CCCCC1 WXVL_AK2569SB0150 [0,1,0,1,0,0|1,0,0]=3 261 B13R1.337 CC(=O)NCCCN1CCCCC1 WXVL_AK2569SB0150 [0,1,0,1,0,0|1,0,0]=3 262 B13R1.337 CC(=O)NCCCN1CCOCC1 WXVL_AK0017SB0150 [0,1,0,1,0,0|2,0,0]=4 263 B13R1.337 CC(=O)NCCCN1CCOCC1 WXVL_AK0017SB0150 [0,1,0,1,0,0|2,0,0]=4 264 B13R1.337 CC(=O)NCCOC1CCCCC1 WXVL_AK3994SB0150 [0,1,0,1,0,0|1,0,0]=3 265 B13R1.337 CC(=O)NCCOC1CCCCC1 WXVL_AK3994SB0150 [0,1,0,1,0,0|1,0,0]=3 266 B13R1.513 CC(=O)NCCN1CCC(CC1)C WXVL_AK0122SB0150 [0,1,0,1,0,0|2,0,0]=4 267 B13R1.513 CC(=O)NCCN1CCC(CC1)C WXVL_AK0122SB0150 [0,1,0,1,0,0|2,0,0]=4 268 B13R1.572 COCCC1CCCCN1C(=O)C WXVL_AN2371SB0150 [0,1,0,1,0,0|1,0,0]=3 269 B13R1.572 COCCC1CCCCN1C(=O)C WXVL_AN2371SB0150 [0,1,0,1,0,0|1,0,0]=3 270 B13R1.382 CCC(=O)N1CCCCC1CCO WXVL_AN2918SB0064 [0,1,0,1,0,0|2,0,0]=4 271 B13R1.382 CCC(=O)N1CCCCC1COC WXVL_AN0507SB0064 [0,1,0,1,0,0|2,0,0]=4 272 B13R1.382 CCC(=O)N1CCCCC1COC WXVL_AN0507SB0064 [0,1,0,1,0,0|2,0,0]=4 273 B13R1.382 CCC(=O)N1CCCC[C@@H]1CCO WXVL_AN00657SB0064 [0,1,0,1,0,0|2,0,0]=4 274 B13R1.382 COCC1CCCCN1C(=O)CO WXVL_AN0507SB2706 [0,1,0,1,0,0|2,0,0]=4 275 B13R1.382 COCC1CCCCN1C(=O)CO WXVL_AN0507SB2706 [0,1,0,1,0,0|2,0,0]=4 276 B13R1.382 O=C(CO)N1CCCCC1CCO WXVL_AN2918SB2706 [0,1,0,1,0,0|2,0,0]=4 277 B13R1.382 O=C(CO)N1CCCC[C@@H]1CCO WXVL_AN00657SB2706 [0,1,0,1,0,0|2,0,0]=4 278 B13R1.536 CCC(=O)NCCCN1CCCC1 WXVL_AK0085SB0064 [0,1,0,1,0,0|2,0,0]=4 279 B13R1.536 CCC(=O)NCCCN1CCCC1 WXVL_AK0085SB0064 [0,1,0,1,0,0|2,0,0]=4 280 B13R1.536 CCC(=O)NCCOC1CCCC1 WXVL_AK3996SB0064 [0,1,0,1,0,0|2,0,0]=4 281 B13R1.536 CCC(=O)NCCOC1CCCC1 WXVL_AK3996SB0064 [0,1,0,1,0,0|2,0,0]=4 282 B13R1.536 O=C(CO)NCCCN1CCCC1 WXVL_AK0085SB2706 [0,1,0,1,0,0|2,0,0]=4 283 B13R1.536 O=C(CO)NCCCN1CCCC1 WXVL_AK0085SB2706 [0,1,0,1,0,0|2,0,0]=4 284 B13R1.536 O=C(CO)NCCOC1CCCC1 WXVL_AK3996SB2706 [0,1,0,1,0,0|2,0,0]=4 285 B13R1.536 O=C(CO)NCCOC1CCCC1 WXVL_AK3996SB2706 [0,1,0,1,0,0|2,0,0]=4 286 B13R1.581 C#CC(=O)N1CCCC1CCCC WXVL_AN00739SB0338 [0,1,0,1,0,0|1,0,1]=4 287 B13R1.581 CCCCC1CCCN1C(=O)CC WXVL_AN00739SB0064 [0,1,0,1,0,0|1,0,0]=3 288 B13R1.581 CCCCC1CCCN1C(=O)CO WXVL_AN00739SB2706 [0,1,0,1,0,0|1,0,0]=3 289 B13R1.599 CCC(=O)NCCC1CCCN1C WXVL_AK2343SB0064 [0,1,0,1,0,0|2,0,0]=4 290 B13R1.599 CCC(=O)NCCC1CCCN1C WXVL_AK2343SB0064 [0,1,0,1,0,0|2,0,0]=4 291 B13R1.599 CN1CCCC1CCNC(=O)CO WXVL_AK2343SB2706 [0,1,0,1,0,0|2,0,0]=4 292 B13R1.599 CN1CCCC1CCNC(=O)CO WXVL_AK2343SB2706 [0,1,0,1,0,0|2,0,0]=4 293 B13R1.718 C#CC(=O)NCCC1CCCCC1 WXVL_AK1287SB0338 [0,1,0,1,0,0|1,0,1]=4 294 B13R1.718 C#CC(=O)NCCC1CCCCC1 WXVL_AK1287SB0338 [0,1,0,1,0,0|1,0,1]=4 295 B13R1.718 CCC(=O)NCCC1CCCCC1 WXVL_AK1287SB0064 [0,1,0,1,0,0|1,0,0]=3 296 B13R1.718 CCC(=O)NCCC1CCCCC1 WXVL_AK1287SB0064 [0,1,0,1,0,0|1,0,0]=3 297 B13R1.718 CCC(=O)NCCC1CCOCC1 WXVL_AK0294SB0064 [0,1,0,1,0,0|2,0,0]=4 298 B13R1.718 CCC(=O)NCCC1CCOCC1 WXVL_AK0294SB0064 [0,1,0,1,0,0|2,0,0]=4 299 B13R1.718 CCC(=O)NCCN1CCCCC1 WXVL_AK0023SB0064 [0,1,0,1,0,0|2,0,0]=4 300 B13R1.718 CCC(=O)NCCN1CCCCC1 WXVL_AK0023SB0064 [0,1,0,1,0,0|2,0,0]=4 301 B13R1.718 O=C(CO)NCCC1CCCCC1 WXVL_AK1287SB2706 [0,1,0,1,0,0|1,0,0]=3 302 B13R1.718 O=C(CO)NCCC1CCCCC1 WXVL_AK1287SB2706 [0,1,0,1,0,0|1,0,0]=3 303 B13R1.718 O=C(CO)NCCC1CCOCC1 WXVL_AK0294SB2706 [0,1,0,1,0,0|2,0,0]=4 304 B13R1.718 O=C(CO)NCCC1CCOCC1 WXVL_AK0294SB2706 [0,1,0,1,0,0|2,0,0]=4 305 B13R1.718 O=C(CO)NCCN1CCCCC1 WXVL_AK0023SB2706 [0,1,0,1,0,0|2,0,0]=4 306 B13R1.718 O=C(CO)NCCN1CCCCC1 WXVL_AK0023SB2706 [0,1,0,1,0,0|2,0,0]=4 307 B13R1.1110 CC(=O)C(=O)NCCC1CCCC1 WXVL_AK00531SB0051 [0,1,0,1,0,0|2,0,0]=4 308 B13R1.1110 CC(=O)C(=O)NCCC1CCCC1 WXVL_AK00531SB0051 [0,1,0,1,0,0|2,0,0]=4 309 B13R1.168 CC(=O)OCC(=O)N1CCC[C@H]1C WXVL_AN00593SB2824 [0,1,0,1,0,0|1,0,1]=4 310 B13R1.1054 CC(=O)OCC(=O)NCC1CCC1 WXVL_AK00492SB2824 [0,1,0,1,0,0|1,0,1]=4 311 B13R1.1054 CC(=O)OCC(=O)NCC1CCC1 WXVL_AK00492SB2824 [0,1,0,1,0,0|1,0,1]=4 312 B13R1.1055 CC(=O)OCC(=O)NCCC1CC1 WXVL_AK00594SB2824 [0,1,0,1,0,0|1,0,1]=4 313 B13R1.1055 CC(=O)OCC(=O)NCCC1CC1 WXVL_AK00594SB2824 [0,1,0,1,0,0|1,0,1]=4 314 B13R1.589 CC(=O)N1CCOC[C@H]1CC(C)C WXVL_AN00804SB0150 [0,1,0,1,0,0|2,0,0]=4 315 B13R2.430 CC(=O)N1CCN2CCC[C@@H]2C1 WXVL_AN2926SB0150 [0,0,0,2,0,0|2,0,0]=4 316 B13R2.430 CC(=O)N1CCN2CCC[C@H]2C1 WXVL_AN00689SB0150 [0,0,0,2,0,0|2,0,0]=4 317 B13R2.430 CC(=O)N1CC[C@@H]2COC[C@@H]2C1 WXVL_AN00207SB0150 [0,0,0,2,0,0|2,0,0]=4 318 B13R2.430 CC(=O)N1CC[C@@H]2COC[C@@H]2C1 WXVL_AN00207SB0150 [0,0,0,2,0,0|2,0,0]=4 319 B13R2.435 CC(=O)N1CC2CCCCC2C1 WXVL_AN0449SB0150 [0,0,0,2,0,0|1,0,0]=3 320 B13R2.435 CC(=O)N1CC2CCCCC2C1 WXVL_AN0449SB0150 [0,0,0,2,0,0|1,0,0]=3 321 B13R2.435 CC(=O)N1C[C@H]2CCCC[C@H]2C1 WXVL_AN00705SB0150 [0,0,0,2,0,0|1,0,0]=3 322 B13R2.437 CC(=O)N1CCC12CCCCC2 WXVL_AN0679SB0150 [0,0,0,2,0,0|1,0,0]=3 323 B13R2.437 CC(=O)N1CCC12CCCCC2 WXVL_AN0679SB0150 [0,0,0,2,0,0|1,0,0]=3 324 B13R2.5559 CC(=O)N1CCN2CCC1CC2 WXVL_AN3774SB0150 [0,0,0,2,0,0|2,0,0]=4 325 B13R2.13779 CC(=O)N1C2CCCC1COC2 WXVL_AN3631SB0150 [0,0,0,2,0,0|2,0,0]=4 326 B13R2.13779 CC(=O)N1C2CCCC1COC2 WXVL_AN3631SB0150 [0,0,0,2,0,0|2,0,0]=4