0 B12R1.5 C(=O)C1=CC=C(C(=O)OC)C=C1 HY-78000 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.5 C=CC1=CC=C(C(=O)OC)C=C1 HY-W008542 [0,0,0,0,0,0|1,0,1]=2 2 B12R1.5 CCC1=CC=C(C(=O)OC)C=C1 HY-W099871 [0,0,0,0,0,0|1,0,0]=1 3 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 HY-W015342 [0,0,0,0,0,0|0,0,0]=0 4 B12R1.5 COC(=O)C1=CC=C(O[Na])C=C1 HY-W016806 [0,0,0,0,0,0|1,0,0]=1 5 B12R1.5 COC1=CC=C(C(=O)CBr)C=C1 HY-W013478 [0,0,0,0,0,0|2,0,0]=2 6 B12R1.5 N#CC1=CC=C(C(=O)CBr)C=C1 HY-79638 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 HY-W007533 [1,0,0,0,0,0|1,0,1]=3 8 B11R1.3 COC1=CC=C(B(O)O)C=N1 HY-32957 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.3 COC1=CC=C(C(=O)O)C=C1 HY-N1394 [1,0,0,0,0,0|0,0,0]=1 10 B11R1.3 COC1=CC=C(C(=O)O)C=C1 HY-N1394R [1,0,0,0,0,0|0,0,0]=1 11 B11R1.3 COC1=CC=C(C(C)=O)C=C1 HY-Y0024 [1,0,0,0,0,0|0,0,0]=1 12 B11R1.3 COC1=CC=C(C(N)=O)C=N1 HY-112584 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.3 COC1=CC=C(C(N)=S)C=C1 HY-W017115 [1,0,0,0,0,0|1,1,0]=3 14 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 HY-B1258 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 HY-W017382 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 HY-21496 [1,0,0,0,0,0|2,0,0]=3 17 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 HY-W017384 [1,0,0,0,0,0|2,0,0]=3 18 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 HY-W017446 [1,0,0,0,0,0|2,0,0]=3 19 B11R1.22 CC1=CC=C(C(=N)NO)C=C1 HY-W055845 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 HY-B1353 [1,0,0,0,0,0|1,0,0]=2 21 B11R1.22 CCC(C)C1=CC=C(O)C=C1 HY-23497 [1,0,0,0,0,0|2,0,1]=4 22 B11R1.22 COC(=O)C1=CC=C(O)C=C1 HY-N0349 [1,0,0,0,0,0|0,0,0]=1 23 B11R1.22 COC(=O)C1=CC=C(O)C=C1 HY-N0349R [1,0,0,0,0,0|0,0,0]=1 24 B11R1.22 COC(=O)C1=CN=C(C)C=C1 HY-76047 [1,0,0,0,0,0|1,0,0]=2 25 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 HY-32778 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.22 COC(=O)C1=NC=C(O)C=C1 HY-W005963 [1,0,0,0,0,0|1,0,0]=2 27 B11R1.22 C\C(=N/O)C1=CC=C(O)C=C1 HY-135325 [1,0,0,0,0,0|3,0,0]=4 28 B11R1.22 NC1=CC=C(C(=O)O[Na])C=C1 HY-W010169 [1,0,0,0,0,0|2,0,0]=3 29 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 HY-B0880 [1,0,0,0,0,0|3,0,0]=4 30 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 HY-W008598 [1,0,0,0,0,0|3,0,0]=4 31 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 HY-W002314 [1,0,0,0,0,0|2,0,0]=3 32 B11R1.22 O=C(O[Na])C1=CC=C(O)C=C1 HY-W010164 [1,0,0,0,0,0|1,0,0]=2 33 B11R1.83 C=CCC1=CC=C(OC)C=C1 HY-N5060 [1,0,0,0,0,0|1,0,2]=4 34 B11R1.83 COC1=CC=C(CCO)C=C1 HY-W004056 [1,0,0,0,0,0|2,0,1]=4 35 B11R1.83 COC1=CC=C(N=C=S)C=C1 HY-W540232 [1,0,0,0,0,0|3,0,0]=4 36 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 HY-N0367 [1,0,0,0,0,0|1,0,0]=2 37 B13R1.95 COC1=CC(O)=C(C(=O)O[K])C=C1 HY-W097858 [0,1,0,0,0,0|1,0,0]=2 38 B13R1.452 CCOC(=O)C1=CC=C(O[Na])C=C1 HY-W099118 [0,1,0,0,0,0|1,0,0]=2 39 B13R1.537 COC(=O)C1=CC=C(B(O)O)C=C1 HY-W003977 [0,1,0,0,0,0|2,0,0]=3 40 B13R1.3088 COC(=O)C1=CC=C(OC)C(O)=C1 HY-W002773 [0,1,0,0,0,0|0,0,0]=1 41 B13R2.2130 COC1=CC2=C(C=C1)C(=O)CC2 HY-W001196 [0,0,0,1,0,0|1,0,0]=2 42 B10R1.3 C#CC1=CC=C(OC)C=C1 HY-W004104 [2,0,0,0,0,0|0,0,2]=4 43 B10R1.3 CCC1=CC=C(C=O)C=C1 HY-W012657 [2,0,0,0,0,0|1,0,0]=3 44 B10R1.3 COC1=CC=C(C=O)C=C1 HY-Y0740 [2,0,0,0,0,0|0,0,0]=2 45 B10R1.3 COC1=CC=C(C=O)C=N1 HY-32788 [2,0,0,0,0,0|1,0,0]=3 46 B10R1.3 COC1=CC=C(CO)C=C1 HY-W015777 [2,0,0,0,0,0|0,0,1]=3 47 B10R1.3 COC1=CC=C(OC)C=C1 HY-W015780 [2,0,0,0,0,0|0,0,0]=2 48 B10R1.3 COC1=CC=C(OC)C=C1 HY-W015780R [2,0,0,0,0,0|0,0,0]=2 49 B10R1.3 COC1=CN=C(OC)C=C1 HY-W051248 [2,0,0,0,0,0|1,0,0]=3 50 B10R1.3 O=CC1=CC=C(C=O)C=C1 HY-Y0425 [2,0,0,0,0,0|2,0,0]=4 51 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 HY-20436 [2,0,0,0,0,0|1,0,0]=3 52 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 HY-60206 [2,0,0,0,0,0|2,0,0]=4 53 B10R1.13 CC(=O)C1=CC=C(C)C=C1 HY-W012653 [2,0,0,0,0,0|0,0,0]=2 54 B10R1.13 CC(=O)C1=CC=C(F)C=C1 HY-Y0779 [2,0,0,0,0,0|1,0,0]=3 55 B10R1.13 CC(=O)C1=CC=C(N)C=C1 HY-W008818 [2,0,0,0,0,0|1,0,0]=3 56 B10R1.13 CC(=O)C1=CC=C(O)C=C1 HY-Y0073 [2,0,0,0,0,0|0,0,0]=2 57 B10R1.13 CC(=O)C1=CC=C(O)C=C1 HY-Y0073R [2,0,0,0,0,0|0,0,0]=2 58 B10R1.13 CC1=CC=C(B(O)O)C=C1 HY-21626 [2,0,0,0,0,0|1,0,1]=4 59 B10R1.13 CC1=CC=C(C(=O)O)C=C1 HY-76547 [2,0,0,0,0,0|0,0,0]=2 60 B10R1.13 CC1=CC=C(C(N)=S)C=C1 HY-W017393 [2,0,0,0,0,0|1,1,0]=4 61 B10R1.13 CC1=CN=C(C(=O)O)C=N1 HY-32739 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.13 CC1=NC=C(C(=O)O)C=C1 HY-W008333 [2,0,0,0,0,0|1,0,0]=3 63 B10R1.13 CC1=NC=C(C(N)=O)C=C1 HY-W015815 [2,0,0,0,0,0|2,0,0]=4 64 B10R1.13 CN(C)C1=CC=C(O)C=C1 HY-34154 [2,0,0,0,0,0|2,0,0]=4 65 B10R1.13 Cc1ccc(C(C)C)cc1 HY-79986 [2,0,0,0,0,0|1,0,1]=4 66 B10R1.13 NC(=O)C1=CC=C(N)C=C1 HY-W017041 [2,0,0,0,0,0|2,0,0]=4 67 B10R1.13 NC(=O)C1=CC=C(O)C=C1 HY-W088191 [2,0,0,0,0,0|1,0,0]=3 68 B10R1.13 NC1=CC=C(C(=O)O)C=C1 HY-B1008 [2,0,0,0,0,0|1,0,0]=3 69 B10R1.13 NC1=CC=C(C(=O)O)C=C1 HY-B1008R [2,0,0,0,0,0|1,0,0]=3 70 B10R1.13 NC1=NC=C(C(=O)O)C=C1 HY-W015793 [2,0,0,0,0,0|2,0,0]=4 71 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 HY-W002864 [2,0,0,0,0,0|2,0,0]=4 72 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 HY-41465 [2,0,0,0,0,0|1,0,0]=3 73 B10R1.13 O=C(O)C1=CC=C(F)C=C1 HY-W013677 [2,0,0,0,0,0|1,0,0]=3 74 B10R1.13 O=C(O)C1=CC=C(I)C=C1 HY-W013396 [2,0,0,0,0,0|1,0,0]=3 75 B10R1.13 O=C(O)C1=CC=C(O)C=C1 HY-Y0264 [2,0,0,0,0,0|0,0,0]=2 76 B10R1.13 O=C(O)C1=CC=C(O)C=C1 HY-Y0264R [2,0,0,0,0,0|0,0,0]=2 77 B10R1.13 O=C(O)C1=CC=C(O)N=C1 HY-W001996 [2,0,0,0,0,0|1,0,0]=3 78 B10R1.13 O=C(O)C1=NC=C(I)C=C1 HY-W041657 [2,0,0,0,0,0|2,0,0]=4 79 B10R1.13 O=C(O)C1=NC=C(O)N=C1 HY-76210 [2,0,0,0,0,0|2,0,0]=4 80 B10R1.13 O=C1C=CC(C(=O)O)=CO1 HY-32004 [2,0,0,0,0,0|1,0,1]=4 81 B10R1.1 CCOC1=CC=C(O)C=C1 HY-W015786 [2,0,0,0,0,0|2,0,0]=4 82 B10R1.15 CNC(=O)C1=CC=CC=C1 HY-135848 [2,0,0,0,0,0|1,0,0]=3 83 B10R1.15 CNC(=O)C1=CC=CC=C1 HY-KE7004 [2,0,0,0,0,0|1,0,0]=3 84 B10R1.15 CNC(=O)C1=CC=CN=C1 HY-124124 [2,0,0,0,0,0|2,0,0]=4 85 B10R1.15 COC(=O)C1=CC=CC=N1 HY-W005458 [2,0,0,0,0,0|1,0,0]=3 86 B10R1.15 COC(=O)C1=NC=CC=N1 HY-78337 [2,0,0,0,0,0|2,0,0]=4 87 B10R1.15 O=C(NO)C1=CC=CC=C1 HY-Y1058 [2,0,0,0,0,0|2,0,0]=4 88 B10R1.15 O=C(O[K])C1=CC=CC=C1 HY-W103932 [2,0,0,0,0,0|1,0,0]=3 89 B10R1.15 O=C(O[Na])C1=CC=CC=C1 HY-Y1316 [2,0,0,0,0,0|1,0,0]=3 90 B10R1.15 O=S(O[Na])C1=CC=CC=C1 HY-W013598 [2,0,0,0,0,0|2,0,0]=4 91 B10R1.15 [Li]OC(=O)C1=CC=CC=C1 HY-N0216A [2,0,0,0,0,0|1,0,0]=3 92 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 HY-N6864 [1,1,0,0,0,0|0,0,0]=2 93 B12R1.48 COC1=CC=C(B(O)O)C=C1F HY-32922 [1,1,0,0,0,0|1,0,1]=4 94 B12R1.48 COC1=CC=C(C(=O)O)C=C1C HY-59384 [1,1,0,0,0,0|0,0,0]=2 95 B12R1.48 COC1=CC=C(C(C)=O)C=C1O HY-W002484 [1,1,0,0,0,0|0,0,0]=2 96 B12R1.256 CC(=O)C1=CC=C(B(O)O)C=C1 HY-32933 [1,1,0,0,0,0|2,0,0]=4 97 B12R1.256 CC(=O)C1=CC=C(C(=O)O)C=C1 HY-W001939 [1,1,0,0,0,0|1,0,0]=3 98 B12R1.256 CC(=O)C1=CC=C([N+](=O)[O-])C=C1 HY-Y0185 [1,1,0,0,0,0|2,0,0]=4 99 B12R1.256 CC(C)C1=CC=C(C(=O)O)C=C1 HY-W013571 [1,1,0,0,0,0|1,0,0]=3 100 B12R1.256 O=C(O)C1=CC=C(B(O)O)C=C1 HY-75102 [1,1,0,0,0,0|2,0,0]=4 101 B12R1.256 O=C(O)C1=CC=C(C(=O)O)C=C1 HY-W010098 [1,1,0,0,0,0|2,0,0]=4 102 B12R1.256 O=C(O)C1=CC=C(C(=O)O)C=C1 HY-W010098R [1,1,0,0,0,0|2,0,0]=4 103 B12R1.256 O=C(O)C1=CC=C([N+](=O)[O-])C=C1 HY-Y0607 [1,1,0,0,0,0|2,0,0]=4 104 B12R1.256 O=[13C](O)C1=CC=C([13C](=O)O)C=C1 HY-W010098S1 [1,1,0,0,0,0|2,0,0]=4 105 B12R1.452 COC1=CC(O)=C(C(=O)O)C=C1 HY-75625 [1,1,0,0,0,0|0,0,0]=2 106 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 HY-N0159 [1,1,0,0,0,0|0,0,0]=2 107 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 HY-N0159R [1,1,0,0,0,0|0,0,0]=2 108 B12R1.9 CC1=CC=C(S(=O)(=O)O[Na])C=C1 HY-W004048 [1,1,0,0,0,0|2,0,0]=4 109 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 HY-Y0258 [1,1,0,0,0,0|1,0,0]=3 110 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 HY-Y0258A [1,1,0,0,0,0|1,0,0]=3 111 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 HY-Y0258R [1,1,0,0,0,0|1,0,0]=3 112 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 HY-B0934 [1,1,0,0,0,0|0,0,0]=2 113 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 HY-B0934R [1,1,0,0,0,0|0,0,0]=2 114 B12R1.20 CC(Br)C(=O)C1=CC=C(Cl)C=C1 HY-W045376 [1,1,0,0,0,0|2,0,0]=4 115 B12R1.367 COC(=O)C1=CC(N)=C(O)C=C1 HY-W005637 [1,1,0,0,0,0|0,0,0]=2 116 B12R1.367 COC(=O)C1=CC=C(N)C(C)=C1 HY-W002375 [1,1,0,0,0,0|1,0,0]=3 117 B12R1.367 COC(=O)C1=CC=C(O)C(O)=C1 HY-Z0548 [1,1,0,0,0,0|0,0,0]=2 118 B12R1.367 O=C(NO)C1=CC=C(O)C(O)=C1 HY-19387 [1,1,0,0,0,0|2,0,0]=4 119 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)N=C1 HY-W022073 [1,1,0,0,0,0|2,0,0]=4 120 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 HY-W010076 [1,1,0,0,0,0|0,0,0]=2 121 B12R1.1703 NC1=CC(O)=C(C(=O)O[Na])C=C1 HY-I0447A [1,1,0,0,0,0|2,0,0]=4 122 B12R1.71 COC1=CC=C(\C=C\C=O)C=C1 HY-W013605A [1,1,0,0,0,0|1,0,1]=4 123 B14R1.718 COC(=O)C1=CC=C(C(=O)OC)C=C1 HY-Y0383 [0,2,0,0,0,0|0,0,0]=2 124 B14R1.718 COC(=O)C1=CC=C(C(=O)OC)C=C1 HY-Y0383R [0,2,0,0,0,0|0,0,0]=2 125 B14R1.718 O=C(O[Na])C1=CC=C(C(=O)O[Na])C=C1 HY-W250127 [0,2,0,0,0,0|2,0,0]=4 126 B14R1.610 CCOC(=O)C1=CC=C([N+](=O)[O-])C=C1 HY-41464 [0,2,0,0,0,0|2,0,0]=4 127 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 HY-40190 [1,0,0,1,0,0|2,0,0]=4 128 B12R2.612 O=C1NCC2=C1C=CC(Br)=C2 HY-34097 [1,0,0,1,0,0|2,0,0]=4 129 B12R2.612 O=C1OCC2=CC(Br)=CC=C12 HY-W007667 [1,0,0,1,0,0|1,0,0]=3 130 B14R2.1801 COC1=CC2=C(C=C1)C(=O)CCC2 HY-34408 [0,1,0,1,0,0|1,0,0]=3 131 B10R0.46 C=C(CC(=O)OC)C(=O)OC HY-W041892 [0,0,1,0,1,0|1,0,1]=4 132 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 HY-135326 [1,0,0,0,0,1|1,0,0]=3 133 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 HY-W001084 [1,0,0,0,0,1|0,0,0]=2 134 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 HY-W001084R [1,0,0,0,0,1|0,0,0]=2