0 B13R0.54 CC(=O)NCCCOCCOCCO WXVL_AK9828SB0150 [0,0,0,0,0,0|4,0,0]=4 1 B13R0.54 CC(=O)NCCCOCCOCCO WXVL_AK9828SB0150 [0,0,0,0,0,0|4,0,0]=4 2 B13R0.54 CCCCCCCCCCCC(=O)N WXVL_AK0084SB2796 [0,0,0,0,0,0|2,0,0]=2 3 B13R0.54 CCCCCCCCCCCC(=O)N WXVL_AK0084SB2796 [0,0,0,0,0,0|2,0,0]=2 4 B13R0.54 CCCCCCCCCCNC(=O)C WXVL_AK1845SB0150 [0,0,0,0,0,0|1,0,0]=1 5 B13R0.54 CCCCCCCCCCNC(=O)C WXVL_AK1845SB0150 [0,0,0,0,0,0|1,0,0]=1 6 B13R0.54 COCCOCCOCCNC(=O)C WXVL_AK1800SB0150 [0,0,0,0,0,0|4,0,0]=4 7 B13R0.54 COCCOCCOCCNC(=O)C WXVL_AK1800SB0150 [0,0,0,0,0,0|4,0,0]=4 8 B12R0.234 C=CCCCCCCCCC(=O)N WXVL_AK0084SB0481 [1,0,0,0,0,0|1,0,2]=4 9 B12R0.234 C=CCCCCCCCCC(=O)N WXVL_AK0084SB0481 [1,0,0,0,0,0|1,0,2]=4 10 B12R0.234 CC(=O)NCCCCCCCCO WXVL_AK4142SB0150 [1,0,0,0,0,0|2,0,0]=3 11 B12R0.234 CC(=O)NCCCCCCCCO WXVL_AK4142SB0150 [1,0,0,0,0,0|2,0,0]=3 12 B12R0.234 CCCCCCCCCCC(=O)N WXVL_AK0084SB0490 [1,0,0,0,0,0|1,0,0]=2 13 B12R0.234 CCCCCCCCCCC(=O)N WXVL_AK0084SB0490 [1,0,0,0,0,0|1,0,0]=2 14 B12R0.234 CCCCCCCCCNC(=O)C WXVL_AK1826SB0150 [1,0,0,0,0,0|1,0,0]=2 15 B12R0.234 CCCCCCCCCNC(=O)C WXVL_AK1826SB0150 [1,0,0,0,0,0|1,0,0]=2 16 B14R0.2 CCCCCCNC(=O)CCNC(=O)C WXVL_AK0286SB0374 [0,1,0,0,0,0|2,0,1]=4 17 B14R0.2 CCCCCCNC(=O)CCNC(=O)C WXVL_AK0286SB0374 [0,1,0,0,0,0|2,0,1]=4 18 B14R0.337 C#CC(=O)NCCCCCCCCCC WXVL_AK1845SB0338 [0,1,0,0,0,0|1,0,1]=3 19 B14R0.337 C#CC(=O)NCCCCCCCCCC WXVL_AK1845SB0338 [0,1,0,0,0,0|1,0,1]=3 20 B14R0.337 CCCCCCCCCCCC(=O)NC WXVL_AK00442SB2796 [0,1,0,0,0,0|1,0,0]=2 21 B14R0.337 CCCCCCCCCCCC(=O)NC WXVL_AK00442SB2796 [0,1,0,0,0,0|1,0,0]=2 22 B14R0.337 CCCCCCCCCCNC(=O)CC WXVL_AK1845SB0064 [0,1,0,0,0,0|1,0,0]=2 23 B14R0.337 CCCCCCCCCCNC(=O)CC WXVL_AK1845SB0064 [0,1,0,0,0,0|1,0,0]=2 24 B14R0.337 CCCCCCCCCCNC(=O)CO WXVL_AK1845SB2706 [0,1,0,0,0,0|1,0,0]=2 25 B14R0.337 CCCCCCCCCCNC(=O)CO WXVL_AK1845SB2706 [0,1,0,0,0,0|1,0,0]=2 26 B14R0.340 CC(=O)C(=O)NCCCCCCCCO WXVL_AK4142SB0051 [0,1,0,0,0,0|3,0,0]=4 27 B14R0.340 CC(=O)C(=O)NCCCCCCCCO WXVL_AK4142SB0051 [0,1,0,0,0,0|3,0,0]=4 28 B14R0.340 CCCCCCCCCCC(=O)N(C)C WXVL_AN0032SB0490 [0,1,0,0,0,0|3,0,0]=4 29 B14R0.340 CCCCCCCCCCC(=O)N(C)C WXVL_AN0032SB0490 [0,1,0,0,0,0|3,0,0]=4 30 B14R0.340 CCCCCCCCCNC(=O)C(=O)C WXVL_AK1826SB0051 [0,1,0,0,0,0|2,0,0]=3 31 B14R0.340 CCCCCCCCCNC(=O)C(=O)C WXVL_AK1826SB0051 [0,1,0,0,0,0|2,0,0]=3 32 B14R0.340 CCCCCCCCCNC(=O)C(=O)N WXVL_AK1826SB0128 [0,1,0,0,0,0|3,0,0]=4 33 B14R0.340 CCCCCCCCCNC(=O)C(=O)N WXVL_AK1826SB0128 [0,1,0,0,0,0|3,0,0]=4 34 B14R0.344 CC(=O)OCC(=O)NCCCCCCO WXVL_AK0751SB2824 [0,1,0,0,0,0|2,0,1]=4 35 B14R0.344 CC(=O)OCC(=O)NCCCCCCO WXVL_AK0751SB2824 [0,1,0,0,0,0|2,0,1]=4 36 B14R0.344 CCCCOCCNC(=O)COC(=O)C WXVL_AK9674SB2824 [0,1,0,0,0,0|2,0,1]=4 37 B14R0.344 CCCCOCCNC(=O)COC(=O)C WXVL_AK9674SB2824 [0,1,0,0,0,0|2,0,1]=4 38 B14R0.394 CC(=O)NCCCCCCCCCCO WXVL_AK3148SB0150 [0,1,0,0,0,0|1,0,0]=2 39 B14R0.394 CC(=O)NCCCCCCCCCCO WXVL_AK3148SB0150 [0,1,0,0,0,0|1,0,0]=2 40 B14R0.394 CCCCCCCCCCCCC(=O)N WXVL_AK0084SB0547 [0,1,0,0,0,0|2,0,0]=3 41 B14R0.394 CCCCCCCCCCCCC(=O)N WXVL_AK0084SB0547 [0,1,0,0,0,0|2,0,0]=3 42 B14R0.394 NC(=O)CCCCCCCCCCCBr WXVL_AK0084SB0603 [0,1,0,0,0,0|2,0,0]=3 43 B14R0.394 NC(=O)CCCCCCCCCCCBr WXVL_AK0084SB0603 [0,1,0,0,0,0|2,0,0]=3 44 B14R0.432 CCCC(=O)NCCCCCNC(=O)C WXVL_AK4207SB0073 [0,1,0,0,0,0|2,0,1]=4 45 B14R0.432 CCCC(=O)NCCCCCNC(=O)C WXVL_AK4207SB0073 [0,1,0,0,0,0|2,0,1]=4 46 B14R1.159 CC(=O)NCCCN1CCCCC1C WXVL_AK1585SB0150 [0,0,0,1,0,0|2,0,0]=3 47 B14R1.159 CC(=O)NCCCN1CCCCC1C WXVL_AK1585SB0150 [0,0,0,1,0,0|2,0,0]=3 48 B14R1.427 CC(=O)NCCCCCN1CCCC1 WXVL_AK00797SB0150 [0,0,0,1,0,0|2,0,0]=3 49 B14R1.427 CC(=O)NCCCCCN1CCCC1 WXVL_AK00797SB0150 [0,0,0,1,0,0|2,0,0]=3 50 B14R1.1454 CC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0150 [0,0,0,1,0,0|1,0,0]=2 51 B14R1.1454 CC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0150 [0,0,0,1,0,0|1,0,0]=2 52 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [2,0,0,0,0,0|1,0,0]=3 53 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [2,0,0,0,0,0|1,0,0]=3 54 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [2,0,0,0,0,0|1,0,0]=3 55 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [2,0,0,0,0,0|1,0,0]=3 56 B11R0.148 CCCCOCCCNC(=O)C WXVL_AK2310SB0150 [2,0,0,0,0,0|2,0,0]=4 57 B11R0.148 CCCCOCCCNC(=O)C WXVL_AK2310SB0150 [2,0,0,0,0,0|2,0,0]=4 58 B13R0.147 CCCCCCCCCCC(=O)NC WXVL_AK00442SB0490 [1,1,0,0,0,0|2,0,0]=4 59 B13R0.147 CCCCCCCCCCC(=O)NC WXVL_AK00442SB0490 [1,1,0,0,0,0|2,0,0]=4 60 B13R0.150 CCCCCCCCNC(=O)C(=O)C WXVL_AK1818SB0051 [1,1,0,0,0,0|1,0,1]=4 61 B13R0.150 CCCCCCCCNC(=O)C(=O)C WXVL_AK1818SB0051 [1,1,0,0,0,0|1,0,1]=4 62 B13R0.154 CCCCCCNC(=O)CCC(=O)C WXVL_AK0286SB0072 [1,1,0,0,0,0|1,0,1]=4 63 B13R0.154 CCCCCCNC(=O)CCC(=O)C WXVL_AK0286SB0072 [1,1,0,0,0,0|1,0,1]=4 64 B13R0.154 CCCCCCNC(=O)COC(=O)C WXVL_AK0286SB2824 [1,1,0,0,0,0|1,0,1]=4 65 B13R0.154 CCCCCCNC(=O)COC(=O)C WXVL_AK0286SB2824 [1,1,0,0,0,0|1,0,1]=4 66 B13R0.280 CCCCCCCCCCS(=O)(=O)N WXVL_AK0084HU0549 [1,1,0,0,0,0|2,0,0]=4 67 B13R0.280 CCCCCCCCCCS(=O)(=O)N WXVL_AK0084HU0549 [1,1,0,0,0,0|2,0,0]=4 68 B15R0.254 CCCCCCCCCCNS(=O)(=O)CC WXVL_AK1845HU0028 [0,2,0,0,0,0|2,0,0]=4 69 B15R0.254 CCCCCCCCCCNS(=O)(=O)CC WXVL_AK1845HU0028 [0,2,0,0,0,0|2,0,0]=4 70 B15R0.345 CCCCC(CC)COCCCNC(=O)C WXVL_AK1966SB0150 [0,2,0,0,0,0|2,0,0]=4 71 B15R0.345 CCCCC(CC)COCCCNC(=O)C WXVL_AK1966SB0150 [0,2,0,0,0,0|2,0,0]=4 72 B15R0.81 C#CC(=O)NCCCCCCCCCCO WXVL_AK3148SB0338 [0,2,0,0,0,0|1,0,1]=4 73 B15R0.81 C#CC(=O)NCCCCCCCCCCO WXVL_AK3148SB0338 [0,2,0,0,0,0|1,0,1]=4 74 B15R0.81 CCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0064 [0,2,0,0,0,0|1,0,0]=3 75 B15R0.81 CCC(=O)NCCCCCCCCCCO WXVL_AK3148SB0064 [0,2,0,0,0,0|1,0,0]=3 76 B15R0.81 CCCCCCCCCCCCC(=O)NC WXVL_AK00442SB0547 [0,2,0,0,0,0|1,0,0]=3 77 B15R0.81 CCCCCCCCCCCCC(=O)NC WXVL_AK00442SB0547 [0,2,0,0,0,0|1,0,0]=3 78 B15R0.81 CNC(=O)CCCCCCCCCCCBr WXVL_AK00442SB0603 [0,2,0,0,0,0|1,0,0]=3 79 B15R0.81 CNC(=O)CCCCCCCCCCCBr WXVL_AK00442SB0603 [0,2,0,0,0,0|1,0,0]=3 80 B15R0.81 O=C(CO)NCCCCCCCCCCO WXVL_AK3148SB2706 [0,2,0,0,0,0|1,0,0]=3 81 B15R0.81 O=C(CO)NCCCCCCCCCCO WXVL_AK3148SB2706 [0,2,0,0,0,0|1,0,0]=3 82 B15R0.84 C=C(F)C(=O)NCCCCCCCCCC WXVL_AK1845SB1376 [0,2,0,0,0,0|1,0,1]=4 83 B15R0.84 C=C(F)C(=O)NCCCCCCCCCC WXVL_AK1845SB1376 [0,2,0,0,0,0|1,0,1]=4 84 B15R0.84 CCCCCCCCCCCC(=O)N(C)C WXVL_AN0032SB2796 [0,2,0,0,0,0|1,0,0]=3 85 B15R0.84 CCCCCCCCCCCC(=O)N(C)C WXVL_AN0032SB2796 [0,2,0,0,0,0|1,0,0]=3 86 B15R0.84 CCCCCCCCCCNC(=O)C(=O)C WXVL_AK1845SB0051 [0,2,0,0,0,0|1,0,0]=3 87 B15R0.84 CCCCCCCCCCNC(=O)C(=O)C WXVL_AK1845SB0051 [0,2,0,0,0,0|1,0,0]=3 88 B15R0.84 CCCCCCCCCCNC(=O)C(=O)N WXVL_AK1845SB0128 [0,2,0,0,0,0|1,0,1]=4 89 B15R0.84 CCCCCCCCCCNC(=O)C(=O)N WXVL_AK1845SB0128 [0,2,0,0,0,0|1,0,1]=4 90 B15R0.84 CCCCCCCCCCNC(=O)C(C)C WXVL_AK1845SB0052 [0,2,0,0,0,0|1,0,0]=3 91 B15R0.84 CCCCCCCCCCNC(=O)C(C)C WXVL_AK1845SB0052 [0,2,0,0,0,0|1,0,0]=3 92 B15R0.84 CCCCCCCCCCNC(=O)C(C)S WXVL_AK1845SB2708 [0,2,0,0,0,0|1,0,0]=3 93 B15R0.84 CCCCCCCCCCNC(=O)C(C)S WXVL_AK1845SB2708 [0,2,0,0,0,0|1,0,0]=3 94 B15R0.84 CCCCCCCCCCNC(=O)C(F)F WXVL_AK1845SB0079 [0,2,0,0,0,0|1,0,0]=3 95 B15R0.84 CCCCCCCCCCNC(=O)C(F)F WXVL_AK1845SB0079 [0,2,0,0,0,0|1,0,0]=3 96 B15R0.84 CCCCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1845SB1085 [0,2,0,0,0,0|1,0,0]=3 97 B15R0.84 CCCCCCCCCCNC(=O)[C@@H](C)O WXVL_AK1845SB1085 [0,2,0,0,0,0|1,0,0]=3 98 B15R0.324 CCCCCCCCCNC(=O)C(=O)CC WXVL_AK1826SB0344 [0,2,0,0,0,0|2,0,0]=4 99 B15R0.324 CCCCCCCCCNC(=O)C(=O)CC WXVL_AK1826SB0344 [0,2,0,0,0,0|2,0,0]=4 100 B15R0.366 C#CCC(=O)NCCCCCCCCCC WXVL_AK1845SB3070 [0,2,0,0,0,0|1,0,0]=3 101 B15R0.366 C#CCC(=O)NCCCCCCCCCC WXVL_AK1845SB3070 [0,2,0,0,0,0|1,0,0]=3 102 B15R0.366 C/C=C/C(=O)NCCCCCCCCCC WXVL_AK1845SB0340 [0,2,0,0,0,0|1,0,0]=3 103 B15R0.366 C/C=C/C(=O)NCCCCCCCCCC WXVL_AK1845SB0340 [0,2,0,0,0,0|1,0,0]=3 104 B15R0.366 C=CCC(=O)NCCCCCCCCCC WXVL_AK1845SB2732 [0,2,0,0,0,0|1,0,0]=3 105 B15R0.366 C=CCC(=O)NCCCCCCCCCC WXVL_AK1845SB2732 [0,2,0,0,0,0|1,0,0]=3 106 B15R0.366 CC#CC(=O)NCCCCCCCCCC WXVL_AK1845SB1240 [0,2,0,0,0,0|1,0,0]=3 107 B15R0.366 CC#CC(=O)NCCCCCCCCCC WXVL_AK1845SB1240 [0,2,0,0,0,0|1,0,0]=3 108 B15R0.366 CCCCCCCCCCCC(=O)NCC WXVL_AK00476SB2796 [0,2,0,0,0,0|1,0,0]=3 109 B15R0.366 CCCCCCCCCCCC(=O)NCC WXVL_AK00476SB2796 [0,2,0,0,0,0|1,0,0]=3 110 B15R0.366 CCCCCCCCCCNC(=O)CC#N WXVL_AK1845SB0057 [0,2,0,0,0,0|1,0,0]=3 111 B15R0.366 CCCCCCCCCCNC(=O)CC#N WXVL_AK1845SB0057 [0,2,0,0,0,0|1,0,0]=3 112 B15R0.366 CCCCCCCCCCNC(=O)CCC WXVL_AK1845SB0073 [0,2,0,0,0,0|1,0,0]=3 113 B15R0.366 CCCCCCCCCCNC(=O)CCC WXVL_AK1845SB0073 [0,2,0,0,0,0|1,0,0]=3 114 B15R0.366 CCCCCCCCCCNC(=O)COC WXVL_AK1845SB0090 [0,2,0,0,0,0|1,0,0]=3 115 B15R0.366 CCCCCCCCCCNC(=O)COC WXVL_AK1845SB0090 [0,2,0,0,0,0|1,0,0]=3 116 B15R0.366 CCCCCCCCCCNC(=O)CSC WXVL_AK1845SB1267 [0,2,0,0,0,0|1,0,0]=3 117 B15R0.366 CCCCCCCCCCNC(=O)CSC WXVL_AK1845SB1267 [0,2,0,0,0,0|1,0,0]=3 118 B15R0.88 CCCCCCCCNC(=O)CCC(=O)C WXVL_AK1818SB0072 [0,2,0,0,0,0|1,0,1]=4 119 B15R0.88 CCCCCCCCNC(=O)CCC(=O)C WXVL_AK1818SB0072 [0,2,0,0,0,0|1,0,1]=4 120 B15R0.88 CCCCCCCCNC(=O)CNC(=O)C WXVL_AK1818SB0357 [0,2,0,0,0,0|1,0,1]=4 121 B15R0.88 CCCCCCCCNC(=O)CNC(=O)C WXVL_AK1818SB0357 [0,2,0,0,0,0|1,0,1]=4 122 B15R0.88 CCCCCCCCNC(=O)COC(=O)C WXVL_AK1818SB2824 [0,2,0,0,0,0|0,0,1]=3 123 B15R0.88 CCCCCCCCNC(=O)COC(=O)C WXVL_AK1818SB2824 [0,2,0,0,0,0|0,0,1]=3 124 B15R0.88 CCCCCCCCNC(=O)CSC(=O)C WXVL_AK1818SB3992 [0,2,0,0,0,0|0,1,1]=4 125 B15R0.88 CCCCCCCCNC(=O)CSC(=O)C WXVL_AK1818SB3992 [0,2,0,0,0,0|0,1,1]=4 126 B15R0.88 CCCCOCCCNC(=O)COC(=O)C WXVL_AK2310SB2824 [0,2,0,0,0,0|1,0,1]=4 127 B15R0.88 CCCCOCCCNC(=O)COC(=O)C WXVL_AK2310SB2824 [0,2,0,0,0,0|1,0,1]=4 128 B15R0.129 CCCCCCCC(=O)NCCNC(=O)C WXVL_AK0057SB0393 [0,2,0,0,0,0|1,0,1]=4 129 B15R0.129 CCCCCCCC(=O)NCCNC(=O)C WXVL_AK0057SB0393 [0,2,0,0,0,0|1,0,1]=4 130 B15R0.164 CCCCCCCCCCCCCC(=O)N WXVL_AK0084SB0562 [0,2,0,0,0,0|2,0,0]=4 131 B15R0.164 CCCCCCCCCCCCCC(=O)N WXVL_AK0084SB0562 [0,2,0,0,0,0|2,0,0]=4 132 B15R0.164 CCCCCCCCCCCCNC(=O)C WXVL_AK1886SB0150 [0,2,0,0,0,0|1,0,0]=3 133 B15R0.164 CCCCCCCCCCCCNC(=O)C WXVL_AK1886SB0150 [0,2,0,0,0,0|1,0,0]=3 134 B13R1.337 CC(=O)NCCCC1CCCCC1 WXVL_AK4112SB0150 [1,0,0,1,0,0|1,0,0]=3 135 B13R1.337 CC(=O)NCCCC1CCCCC1 WXVL_AK4112SB0150 [1,0,0,1,0,0|1,0,0]=3 136 B13R1.337 CC(=O)NCCCN1CCCCC1 WXVL_AK2569SB0150 [1,0,0,1,0,0|2,0,0]=4 137 B13R1.337 CC(=O)NCCCN1CCCCC1 WXVL_AK2569SB0150 [1,0,0,1,0,0|2,0,0]=4 138 B13R1.337 CC(=O)NCCOC1CCCCC1 WXVL_AK3994SB0150 [1,0,0,1,0,0|2,0,0]=4 139 B13R1.337 CC(=O)NCCOC1CCCCC1 WXVL_AK3994SB0150 [1,0,0,1,0,0|2,0,0]=4 140 B13R1.572 COCCC1CCCCN1C(=O)C WXVL_AN2371SB0150 [1,0,0,1,0,0|2,0,0]=4 141 B13R1.572 COCCC1CCCCN1C(=O)C WXVL_AN2371SB0150 [1,0,0,1,0,0|2,0,0]=4 142 B15R1.975 CCC(=O)NCCCCCN1CCCC1 WXVL_AK00797SB0064 [0,1,0,1,0,0|2,0,0]=4 143 B15R1.975 CCC(=O)NCCCCCN1CCCC1 WXVL_AK00797SB0064 [0,1,0,1,0,0|2,0,0]=4 144 B15R1.975 O=C(CO)NCCCCCN1CCCC1 WXVL_AK00797SB2706 [0,1,0,1,0,0|2,0,0]=4 145 B15R1.975 O=C(CO)NCCCCCN1CCCC1 WXVL_AK00797SB2706 [0,1,0,1,0,0|2,0,0]=4 146 B15R1.1091 CC1CCCCN1CCCNC(=O)CO WXVL_AK1585SB2706 [0,1,0,1,0,0|2,0,0]=4 147 B15R1.1091 CC1CCCCN1CCCNC(=O)CO WXVL_AK1585SB2706 [0,1,0,1,0,0|2,0,0]=4 148 B15R1.1091 CCC(=O)NCCCN1CCCCC1C WXVL_AK1585SB0064 [0,1,0,1,0,0|2,0,0]=4 149 B15R1.1091 CCC(=O)NCCCN1CCCCC1C WXVL_AK1585SB0064 [0,1,0,1,0,0|2,0,0]=4 150 B15R1.12436 C#CC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0338 [0,1,0,1,0,0|1,0,1]=4 151 B15R1.12436 C#CC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0338 [0,1,0,1,0,0|1,0,1]=4 152 B15R1.12436 CCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0064 [0,1,0,1,0,0|1,0,0]=3 153 B15R1.12436 CCC(=O)NCCC1CCCCCCC1 WXVL_AK2380SB0064 [0,1,0,1,0,0|1,0,0]=3 154 B15R1.12436 O=C(CO)NCCC1CCCCCCC1 WXVL_AK2380SB2706 [0,1,0,1,0,0|1,0,0]=3 155 B15R1.12436 O=C(CO)NCCC1CCCCCCC1 WXVL_AK2380SB2706 [0,1,0,1,0,0|1,0,0]=3 156 B15R1.3664 CC(=O)C(=O)NCCCC1CCCCC1 WXVL_AK4112SB0051 [0,1,0,1,0,0|2,0,0]=4 157 B15R1.3664 CC(=O)C(=O)NCCCC1CCCCC1 WXVL_AK4112SB0051 [0,1,0,1,0,0|2,0,0]=4 158 B15R1.12292 CC(=O)OCC(=O)NCCC1CCCC1 WXVL_AK00531SB2824 [0,1,0,1,0,0|1,0,1]=4 159 B15R1.12292 CC(=O)OCC(=O)NCCC1CCCC1 WXVL_AK00531SB2824 [0,1,0,1,0,0|1,0,1]=4 160 B15R2.1243 CC(=O)N1CCC[C@H]1CN2CCCC2 WXVL_AN00609SB0150 [0,0,0,2,0,0|2,0,0]=4