0 B13R1.718 NNC(=O)COCC1=CC=CC=C1 RT1588 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.718 O=C(CCCC1=CC=CC=C1)O[Na] RT10772 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.8 CCCCCCC1=CC=CC=C1 JZ4393 [1,0,0,0,0,0|1,0,1]=3 3 B12R1.8 CCCCCCC1=CC=CN=C1 LQ3047 [1,0,0,0,0,0|2,0,1]=4 4 B12R1.8 CCCCOCC1=CC=CC=C1 HL0050 [1,0,0,0,0,0|2,0,1]=4 5 B12R1.8 S=C=NCCCC1=CC=CC=C1 JZ2090 [1,0,0,0,0,0|3,0,0]=4 6 B12R1.252 CC(=O)OCCC1=CC=CC=C1 LL0321 [1,0,0,0,0,0|1,0,0]=2 7 B12R1.252 CC(=O)SCCC1=NC=CC=C1 RT10486 [1,0,0,0,0,0|2,0,0]=3 8 B12R1.252 CC(O)COCC1=CC=CC=C1 RT12344 [1,0,0,0,0,0|1,0,2]=4 9 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 RT12731 [1,0,0,0,0,0|1,0,2]=4 10 B12R1.252 NC(=S)NCCC1=CC=CC=C1 LQ3182 [1,0,0,0,0,0|2,1,0]=4 11 B12R1.252 O=C(O)CCCC1=CC=CC=C1 RT12403 [1,0,0,0,0,0|0,0,0]=1 12 B12R1.252 O=C(O)CCCC1=NC=CC=C1 YH65623 [1,0,0,0,0,0|1,0,0]=2 13 B12R1.252 O=C(O)CCOC1=CC=CC=C1 LT6842 [1,0,0,0,0,0|1,0,0]=2 14 B12R1.252 O=C(O)CNCC1=CC=CC=C1 YH18010 [1,0,0,0,0,0|1,0,0]=2 15 B12R1.252 O=C(O)COCC1=CC=CC=C1 YH53105 [1,0,0,0,0,0|1,0,0]=2 16 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 LQ2010 [1,0,0,0,0,0|0,0,2]=3 17 B14R1.13 COC(=O)CCCC1=CC=C(N)C=C1 YH45209 [0,1,0,0,0,0|0,0,0]=1 18 B14R1.13 COC(=O)CCCC1=CC=C(N)C=C1 YH95035 [0,1,0,0,0,0|0,0,0]=1 19 B14R1.520 CCCC(=O)OCCC1=CC=CC=C1 LL0326 [0,1,0,0,0,0|2,0,0]=3 20 B14R1.520 CCOC(=O)CCNC1=NC=CC=C1 LX2794 [0,1,0,0,0,0|2,0,0]=3 21 B14R1.520 CCOC(=O)CCOC1=CC=CC=C1 LT5144 [0,1,0,0,0,0|1,0,0]=2 22 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 JZ0159 [0,1,0,0,0,0|1,0,0]=2 23 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 JZ2900 [0,1,0,0,0,0|1,0,0]=2 24 B14R1.520 CCOC(=O)C\N=C\C1=CC=CC=C1 RT5039 [0,1,0,0,0,0|1,0,1]=3 25 B14R1.520 C\C(=C\CO)COCC1=CC=CC=C1 RT1266 [0,1,0,0,0,0|3,0,0]=4 26 B14R1.546 COC(COCC1=CC=CC=C1)OC LQ5531 [0,1,0,0,0,0|1,0,2]=4 27 B14R1.743 COC(=O)CC(N)CC1=CC=CC=C1 YH65148 [0,1,0,0,0,0|0,0,0]=1 28 B14R1.837 COC(=O)CCCC1=CC=CC=C1N RT5155 [0,1,0,0,0,0|0,0,0]=1 29 B14R1.6449 CC(C)C(=O)OCCC1=CC=CC=C1 LL0324 [0,1,0,0,0,0|2,0,0]=3 30 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 HL0442 [0,0,0,1,0,0|2,0,0]=3 31 B14R2.19 O=C1CCN(CC2=CC=CC=C2)N1 LT1447 [0,0,0,1,0,0|3,0,0]=4 32 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 RT6827 [0,0,0,1,0,0|1,0,0]=2 33 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CS1 YH46889 [0,0,0,1,0,0|1,1,0]=3 34 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 RT6803 [0,0,0,1,0,0|1,0,0]=2 35 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CS1 YH66520 [0,0,0,1,0,0|1,1,0]=3 36 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CS1 YH24604 [0,0,0,1,0,0|1,2,0]=4 37 B14R2.68 O=C1CCC(C2=CC=CC=C2)CC1 XJ2777 [0,0,0,1,0,0|1,0,0]=2 38 B14R2.68 O=C1CCN(C2=CC=NC=C2)CC1 LT1616 [0,0,0,1,0,0|3,0,0]=4 39 B14R2.95 COC(=O)C1=CNC2=CC=CC=C21 JZ4329 [0,0,0,1,0,0|1,0,2]=4 40 B14R2.95 O=C(CCl)N1CCC2=C1C=CC=C2 LT5812 [0,0,0,1,0,0|3,0,0]=4 41 B14R2.279 NC1C(=O)NCCC2=C1C=CC=C2 YH65765 [0,0,0,1,0,0|3,0,0]=4 42 B14R2.958 COC(=O)C1OC1C2=CC=CC=C2 CJ3281 [0,0,0,1,0,0|1,0,0]=2 43 B14R2.4514 CN1C(=O)CCC1C2=CC=CN=C2 RT14837 [0,0,0,1,0,0|2,0,0]=3 44 B14R2.4514 CN1C(=O)CCC1C2=NC=CC=C2 RT14836 [0,0,0,1,0,0|2,0,0]=3 45 B14R2.4514 CN1C(=O)CCC1C2=NC=CC=C2 RT15142 [0,0,0,1,0,0|2,0,0]=3 46 B14R2.4514 CN1C(=O)CC[C@@H]1C2=CC=CN=C2 RT14838 [0,0,0,1,0,0|2,0,0]=3 47 B14R2.4514 CN1C(=O)CC[C@H]1C2=CC=CN=C2 RT14835 [0,0,0,1,0,0|2,0,0]=3 48 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 JZ3727 [0,0,0,0,1,0|2,0,1]=4 49 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 HL2281 [0,0,0,0,1,0|2,0,1]=4 50 B12R1.27 CCC(=O)OCC1=CC=CC=C1 LT4168 [0,0,0,0,1,0|2,0,0]=3 51 B12R1.27 COC(=O)CCC1=CC=CN=C1 XJ6488 [0,0,0,0,1,0|1,0,0]=2 52 B12R1.27 COC(=O)OCC1=CC=CC=C1 RT11038 [0,0,0,0,1,0|1,0,0]=2 53 B12R1.27 NCC(=O)OCC1=CC=CC=C1 JZ4757 [0,0,0,0,1,0|3,0,0]=4 54 B12R1.27 NCC(=O)OCC1=CC=CC=C1 RT5531 [0,0,0,0,1,0|3,0,0]=4 55 B12R1.27 NNC(=O)CCC1=CN=CC=C1 YH54209 [0,0,0,0,1,0|3,0,0]=4 56 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 YH49901 [0,0,0,0,1,0|3,0,0]=4 57 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 XJ0546 [0,0,0,0,1,0|3,0,0]=4 58 B12R1.27 O=C(CO)OCC1=CC=CC=C1 RT12484 [0,0,0,0,1,0|3,0,0]=4 59 B12R1.27 O=C(COC1=CC=CC=C1)O[Na] JZ0339 [0,0,0,0,1,0|2,0,0]=3 60 B14R1.716 COC(=O)CCCCC1=CC=CC=C1 YH45184 [0,0,0,0,0,1|0,0,0]=1 61 B14R1.716 COC(=O)CCNCC1=CC=CC=C1 RT3212 [0,0,0,0,0,1|0,0,0]=1 62 B11R1.28 BrCCCCC1=CC=CC=C1 LT3814 [2,0,0,0,0,0|1,0,1]=4 63 B11R1.28 CCCCCC1=NC=CC=C1 LT3426 [2,0,0,0,0,0|1,0,1]=4 64 B11R1.28 CCCCOC1=CC=CC=C1 HL0694 [2,0,0,0,0,0|1,0,1]=4 65 B11R1.28 COCCSC1=CC=CC=C1 HL4605 [2,0,0,0,0,0|1,0,0]=3 66 B11R1.28 ClCCCCC1=CC=CC=C1 JZ2628 [2,0,0,0,0,0|1,0,1]=4 67 B11R1.28 NCCCCC1=CC=CC=C1 JZ3683 [2,0,0,0,0,0|1,0,1]=4 68 B11R1.28 O=C=NCCC1=CC=CC=C1 JZ1800 [2,0,0,0,0,0|1,0,1]=4 69 B11R1.28 O=CCOCC1=CC=CC=C1 RT6333 [2,0,0,0,0,0|1,0,0]=3 70 B11R1.28 OCCCCC1=CC=NC=C1 YH65835 [2,0,0,0,0,0|1,0,1]=4 71 B11R1.28 OCCCNC1=CC=CC=C1 LT5756 [2,0,0,0,0,0|1,0,1]=4 72 B11R1.28 OCCCOC1=CC=CC=C1 XJ3053 [2,0,0,0,0,0|1,0,1]=4 73 B11R1.28 OCCNCC1=CC=CC=C1 YH22684 [2,0,0,0,0,0|1,0,1]=4 74 B11R1.28 OCCOCC1=CC=CC=C1 JZ3992 [2,0,0,0,0,0|1,0,1]=4 75 B11R1.28 OCCSCC1=CC=CC=C1 LQ2564 [2,0,0,0,0,0|1,0,1]=4 76 B11R1.28 OCCSCC1=CC=CC=C1 LQ4535 [2,0,0,0,0,0|1,0,1]=4 77 B13R1.9 CCCCCCC1=CC=C(O)C=C1 LT3079 [1,1,0,0,0,0|1,0,1]=4 78 B13R1.28 CCCCCCCC1=CC=CC=C1 JZ4402 [1,1,0,0,0,0|1,0,1]=4 79 B13R1.28 ClCCCCCCC1=CC=CC=C1 RT6312 [1,1,0,0,0,0|1,0,1]=4 80 B13R1.28 ClCCCCCCC1=CC=CC=C1 XJ6223 [1,1,0,0,0,0|1,0,1]=4 81 B13R1.28 NCCCCCCC1=CC=CC=C1 RT3206 [1,1,0,0,0,0|1,0,1]=4 82 B13R1.28 OCCCCCCC1=CC=CC=C1 XJ2142 [1,1,0,0,0,0|1,0,1]=4 83 B13R1.42 CC#CC(O)CCC1=CC=CC=C1 RT6117 [1,1,0,0,0,0|1,0,1]=4 84 B13R1.45 CC(=O)CCC(=O)C1=CC=CC=C1 XJ0998 [1,1,0,0,0,0|0,0,1]=3 85 B13R1.45 CC(=O)OCC(=O)C1=CC=CC=C1 XJ2107 [1,1,0,0,0,0|1,0,1]=4 86 B13R1.45 N[C@H](CCC(=O)O)C1=CC=CC=C1 RT17386 [1,1,0,0,0,0|0,0,0]=2 87 B13R1.45 O=C(O)CCC(=O)C1=CC=NC=C1 RT3513 [1,1,0,0,0,0|1,0,1]=4 88 B13R1.45 O=C(O)CNC(=O)C1=CC=CC=C1 RT15426 [1,1,0,0,0,0|1,0,1]=4 89 B13R1.45 O=C(O)CSC(=O)C1=CC=CC=C1 YH65347 [1,1,0,0,0,0|1,0,1]=4 90 B13R1.149 O=C(O)CCCC1=CC=CC(Br)=C1 YH94168 [1,1,0,0,0,0|0,0,0]=2 91 B13R1.149 O=C(O)CCCC1=CC=CC(S)=C1 RT19807 [1,1,0,0,0,0|0,0,0]=2 92 B13R1.158 O=C(O)CCCC1=CC=CC=C1S RT19806 [1,1,0,0,0,0|0,0,0]=2 93 B13R1.348 O=C(O)CC(=O)NC1=CC=CC=C1 LX2424 [1,1,0,0,0,0|1,0,1]=4 94 B13R1.351 NC(CCC1=CC=CN=C1)C(=O)O HL0623 [1,1,0,0,0,0|1,0,0]=3 95 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O RT5106 [1,1,0,0,0,0|0,0,0]=2 96 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O XJ6799 [1,1,0,0,0,0|0,0,0]=2 97 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 LX2070 [1,1,0,0,0,0|0,0,1]=3 98 B13R1.513 CC(=O)OCCC1=CC=C(O)C=C1 RT6322 [1,1,0,0,0,0|1,0,0]=3 99 B13R1.513 CC1=CC=C(CCCC(=O)O)C=C1 HL2759 [1,1,0,0,0,0|0,0,0]=2 100 B13R1.513 NC1=CC=C(CCCC(=O)O)C=C1 XJ4154 [1,1,0,0,0,0|0,0,0]=2 101 B13R1.513 O=C(O)CCCC1=CC=C(Cl)C=C1 YH02376 [1,1,0,0,0,0|0,0,0]=2 102 B13R1.513 O=C(O)CCCC1=CC=C(F)C=C1 HL0053 [1,1,0,0,0,0|0,0,0]=2 103 B13R1.513 O=C(O)CCCC1=CC=C(S)C=C1 RT19808 [1,1,0,0,0,0|0,0,0]=2 104 B13R1.513 O=C(O)CCOC1=CC=C(Cl)C=C1 LT2484 [1,1,0,0,0,0|1,0,0]=3 105 B13R1.3523 CC(C)(O)CCCC1=CC=CC=C1 YH66179 [1,1,0,0,0,0|0,0,2]=4 106 B13R1.11 CCC(=O)OC(C)C1=CC=CC=C1 LL0475 [0,1,0,0,1,0|2,0,0]=4 107 B13R1.11 CCC(=O)OC(C)C1=CC=CC=C1 LL1950 [0,1,0,0,1,0|2,0,0]=4 108 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 RT5176 [0,1,0,0,1,0|0,0,0]=2 109 B13R1.11 COC(=O)\C=C(/N)C1=CC=CC=C1 CJ2965 [0,1,0,0,1,0|0,0,2]=4 110 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 JZ2791 [0,1,0,0,1,0|0,0,0]=2 111 B13R1.14 COC(=O)COC1=CC=C(Cl)C=C1 YH03119 [0,1,0,0,1,0|1,0,0]=3 112 B13R1.14 COC(=O)\C=C\C1=CC=C(Cl)C=C1 YH66453 [0,1,0,0,1,0|0,0,2]=4 113 B13R1.135 C=C(CC1=CC=CC=C1)C(=O)OC HL2463 [0,1,0,0,1,0|0,0,1]=3 114 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 JZ1435 [0,1,0,0,1,0|0,0,0]=2 115 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 YH33191 [0,1,0,0,1,0|0,0,0]=2 116 B15R1.741 COC(=O)CC(C)NCC1=CC=CC=C1 YH66571 [0,1,0,0,0,1|0,0,0]=2 117 B15R1.959 COC(=O)CCCC(=O)C1=CC=CC=C1 YH35979 [0,1,0,0,0,1|0,0,0]=2 118 B15R1.1321 COC(=O)[C@H](O)COCC1=CC=CC=C1 RT6146 [0,1,0,0,0,1|0,0,0]=2 119 B15R1.89 CCOC(=O)CCC(=O)C1=CC=CN=C1 RT17958 [0,2,0,0,0,0|1,0,1]=4 120 B15R1.89 CCOC(=O)CCC(=O)C1=CC=NC=C1 RT3430 [0,2,0,0,0,0|1,0,1]=4 121 B15R1.1097 CCN(CCC(=O)OC)C1=CC=CC=C1 LT5788 [0,2,0,0,0,0|1,0,0]=3 122 B15R1.633 CCOC(=O)CCCC1=CC(O)=CC=C1 YH37798 [0,2,0,0,0,0|0,0,0]=2 123 B15R1.809 CCOC(=O)CC(=O)CC1=CC=CC=C1 YH15480 [0,2,0,0,0,0|0,0,1]=3 124 B15R1.826 CCOC(=O)C(=O)CCC1=CC=CC=C1 LT5108 [0,2,0,0,0,0|0,0,1]=3 125 B15R1.826 CCOC(=O)[C@@H](N)CCC1=CC=CC=C1 JZ1618 [0,2,0,0,0,0|0,0,0]=2 126 B15R1.826 CCOC(=O)[C@@H](O)CCC1=CC=CC=C1 RT7170 [0,2,0,0,0,0|0,0,0]=2 127 B15R1.826 CCOC(=O)[C@H](C)OCC1=CC=CC=C1 RT6784 [0,2,0,0,0,0|1,0,0]=3 128 B15R1.826 CCOC(=O)[C@H](C)\N=C\C1=CC=CC=C1 RT5133 [0,2,0,0,0,0|1,0,1]=4 129 B15R1.826 [C@@H](O)(CCC1=CC=CC=C1)C(=O)OCC JZ0371 [0,2,0,0,0,0|0,0,0]=2 130 B15R1.11663 CCC(=O)OC(C)(C)CC1=CC=CC=C1 LL1165 [0,2,0,0,0,0|2,0,0]=4 131 B15R1.1370 COC(=O)[C@H](CO)NCC1=CC=CC=C1 RT4982 [0,2,0,0,0,0|1,0,0]=3 132 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 HL0422 [1,0,0,1,0,0|2,0,0]=4 133 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 LT0481 [1,0,0,1,0,0|2,0,0]=4 134 B13R2.3 C1=CC=C(C2COCCN2)C=C1 YH33694 [1,0,0,1,0,0|1,0,1]=4 135 B13R2.3 C1=CC=C([C@@H]2CCCNC2)C=C1 YH08942 [1,0,0,1,0,0|1,0,1]=4 136 B13R2.2382 C1=CC=C(COCC2CO2)C=C1 LT4165 [1,0,0,1,0,0|1,0,1]=4 137 B13R2.2382 C1=CC=C(COC[C@@H]2CO2)C=C1 RT12008 [1,0,0,1,0,0|1,0,1]=4 138 B13R2.2382 C1=CC=C(COC[C@H]2CO2)C=C1 LT4935 [1,0,0,1,0,0|1,0,1]=4 139 B13R2.10 O=C1C=C(C2=CC=CC=C2)CC1 YH65797 [1,0,0,1,0,0|0,0,2]=4 140 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 YH27765 [1,0,0,1,0,0|1,0,0]=3 141 B13R2.10 O=C1CC(C2=CC=CN=C2)CN1 RT10191 [1,0,0,1,0,0|2,0,0]=4 142 B13R2.10 O=C1CCC(C2=CC=CC=C2)O1 HL0603 [1,0,0,1,0,0|0,0,0]=2 143 B13R2.10 O=C1CCC(C2=CC=CN=C2)N1 RT16632 [1,0,0,1,0,0|2,0,0]=4 144 B13R2.10 O=C1NCC(C2=CC=CC=C2)N1 RT9150 [1,0,0,1,0,0|2,0,0]=4 145 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 SY0295 [1,0,0,1,0,0|2,0,0]=4 146 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 RT7870 [1,0,0,1,0,0|2,0,0]=4 147 B13R2.72 O=C(O)C1CNC2=C1C=CC=C2 LX2653 [1,0,0,1,0,0|1,0,0]=3 148 B13R2.163 O=C1CCCC2=C(C=CC=C2)N1 XJ2660 [1,0,0,1,0,0|1,0,0]=3 149 B13R2.423 O=C(O)[C@H]1O[C@@H]1C2=CC=CC=C2 RT15458 [1,0,0,1,0,0|1,0,0]=3 150 B15R2.29 O=C1CCN(CC2=CC=CC=C2)CC1 LT1454 [0,0,0,1,0,1|1,0,0]=3 151 B15R2.4083 CC1C(=O)CCN1CC2=CC=CC=C2 RT2909 [0,0,0,1,0,1|1,0,0]=3 152 B15R2.4083 O=C1CCC(CC2=CC=CC=C2)=C1O LT1869 [0,0,0,1,0,1|2,0,0]=4 153 B15R2.3 O=C1CCC(C2=CC=C(O)C=C2)CC1 YH23128 [0,1,0,1,0,0|1,0,0]=3 154 B15R2.98 NC1=CC=C(CC2COC(=O)N2)C=C1 LT6237 [0,1,0,1,0,0|1,0,0]=3 155 B15R2.23388 COC(=O)C1CC(=O)C2=C1C=CC=C2 CJ2863 [0,1,0,1,0,0|0,0,1]=3 156 B15R2.31 O=C1CCCN(CC2=CC=CC=C2)C1 LT1409 [0,1,0,1,0,0|2,0,0]=4 157 B15R2.31 O=C1CCCN(CC2=CC=CC=C2)C1 XJ5521 [0,1,0,1,0,0|2,0,0]=4 158 B15R2.325 O=C1CC(CC2=CC=CC=C2)C(=O)O1 YH43541 [0,1,0,1,0,0|0,0,1]=3 159 B15R2.325 O=C1N[C@@H](CC2=CC=CC=C2)C(=O)O1 YH35626 [0,1,0,1,0,0|1,0,1]=4 160 B15R2.1342 CCOC(=O)C1OC1C2=CC=CC=C2 LL0501 [0,1,0,1,0,0|1,0,0]=3 161 B15R2.2349 CCN1C(=O)CCC1C2=CC=CN=C2 RT9394 [0,1,0,1,0,0|2,0,0]=4 162 B15R2.314 C=C1CC(CC2=CC=CC=C2)OC1=O YH18413 [0,1,0,1,0,0|2,0,0]=4 163 B15R2.1569 COC(=O)CC1=NC2=CC=CC=C2O1 YH66670 [0,1,0,1,0,0|1,0,1]=4 164 B15R2.1601 COC(=O)[C@@H]1CC2=CC=CC=C2CN1 XJ5772 [0,1,0,1,0,0|1,0,0]=3 165 B15R2.1601 COC(=O)[C@@H]1CCC2=C(C=CC=C2)N1 LT0750 [0,1,0,1,0,0|0,0,0]=2 166 B15R2.28 O=C1CCC(C2=CC=CC(F)=C2)CC1 YH65532 [0,1,0,1,0,0|1,0,0]=3 167 B15R2.7137 CC1=CN=CC(C2CCC(=O)N2C)=C1 RT15135 [0,1,0,1,0,0|2,0,0]=4 168 B15R2.19094 COC(=O)C1CCC2=C1C=CC(N)=C2 CJ2973 [0,1,0,1,0,0|0,0,0]=2 169 B15R2.4092 C[N+]1([O-])C(=O)CCC1C2=CC=CN=C2 RT14832 [0,1,0,1,0,0|2,0,0]=4 170 B11R1.91 C=C(C)COC1=CC=CC=C1 HL3035 [1,0,0,0,1,0|2,0,0]=4 171 B11R1.91 CC(=O)C#CC1=CC=CC=C1 XJ1968 [1,0,0,0,1,0|0,0,2]=4 172 B11R1.91 CC(=O)CCC1=CC=CC=C1 LQ2231 [1,0,0,0,1,0|0,0,0]=2 173 B11R1.91 CC(=O)NNC1=CC=CC=C1 HL1438 [1,0,0,0,1,0|2,0,0]=4 174 B11R1.91 CC(N)CCC1=CC=CC=C1 XJ4684 [1,0,0,0,1,0|1,0,1]=4 175 B11R1.91 NC(=O)COC1=CC=CC=C1 JZ3987 [1,0,0,0,1,0|2,0,0]=4 176 B11R1.91 NC(=O)OCC1=CC=CC=C1 JZ3985 [1,0,0,0,1,0|2,0,0]=4 177 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 RT11201 [1,0,0,0,1,0|1,0,0]=3 178 B11R1.91 O=C(O)C#CC1=CC=CC=C1 JZ4042 [1,0,0,0,1,0|0,0,2]=4 179 B11R1.91 O=C(O)COC1=CC=CC=N1 YH08506 [1,0,0,0,1,0|2,0,0]=4 180 B11R1.91 O=C(O)COC1=CC=CN=C1 LL1584 [1,0,0,0,1,0|2,0,0]=4 181 B11R1.91 O=C(O)CSC1=CC=CC=C1 LL0306 [1,0,0,0,1,0|1,0,0]=3 182 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 LT4563 [1,0,0,0,1,0|0,0,2]=4 183 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 RT12003 [1,0,0,0,1,0|0,0,2]=4 184 B11R1.91 O=C([O-])CNC1=CC=CC=C1 LT5790 [1,0,0,0,1,0|1,0,1]=4 185 B11R1.25 COC(=O)CCC1=CC=CN1 RT6367 [0,0,0,0,2,0|1,0,0]=3 186 B11R1.25 COC(=O)CCC1=CC=CS1 RT13132 [0,0,0,0,2,0|1,0,0]=3 187 B11R1.25 COC(=O)CCC1=CNC=N1 RT17517 [0,0,0,0,2,0|2,0,0]=4 188 B11R1.40 NCC(=O)CC1=CC=CC=C1 RT12543 [0,0,0,0,2,0|2,0,0]=4 189 B11R1.40 NNC(=O)CC1=CC=CC=C1 JZ4307 [0,0,0,0,2,0|2,0,0]=4 190 B11R1.40 O=C(CBr)CC1=CC=CC=C1 RT10869 [0,0,0,0,2,0|2,0,0]=4 191 B11R1.40 O=C(CO)CC1=CC=CC=C1 RT6783 [0,0,0,0,2,0|2,0,0]=4 192 B15R1.962 COC(=O)C#CCOCC1=CC=CC=C1 RT12367 [0,0,0,0,0,2|0,0,1]=3