0 B13R1.3 CC(=O)OCC1=CC=C(C=C1)C#N BOG00136 [0,0,0,0,0,0|2,0,0]=2 1 B13R1.3 COC1=CC=C(C=C1)/C=C/C(=O)O T135062 [0,0,0,0,0,0|2,0,1]=3 2 B13R1.3 COC1=CC=C(C=C1)CCC(=O)Cl PH014654 [0,0,0,0,0,0|2,0,0]=2 3 B13R1.3 COC1=CC=C(C=C1)CCC(C)N PH009720 [0,0,0,0,0,0|2,0,1]=3 4 B13R1.3 COC1=CC=C(C=C1)OCC(=O)O S616656 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.21 CC(=CCC1=CC=C(C=C1)O)C S369632 [1,0,0,0,0,0|2,0,0]=3 6 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)Br TMT00515 [1,0,0,0,0,0|2,0,1]=4 7 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)F CDS016057 [1,0,0,0,0,0|2,0,1]=4 8 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)O S350656 [1,0,0,0,0,0|1,0,1]=3 9 B12R1.21 CC(=O)CSC1=CC=C(C=C1)Br VBP00216 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Cl PH009464 [1,0,0,0,0,0|2,0,0]=3 11 B12R1.21 CC(=O)OCC1=CC=C(C=C1)C S528498 [1,0,0,0,0,0|0,0,0]=1 12 B12R1.21 CC(C)CCC1=CC=C(C=C1)O S511803 [1,0,0,0,0,0|2,0,1]=4 13 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)N R640662 [1,0,0,0,0,0|2,0,1]=4 14 B12R1.21 CC1=CC=C(C=C1)OCC(=O)Cl OTV000056 [1,0,0,0,0,0|3,0,0]=4 15 B12R1.21 CC1=CC=C(C=C1)SCC(=O)O S755710 [1,0,0,0,0,0|3,0,0]=4 16 B12R1.21 CC1=CC=[N+](C=C1)CCC(=O)N S343307 [1,0,0,0,0,0|3,0,0]=4 17 B12R1.21 CC1=CC=[N+](C=C1)CCC(=O)O OTV000678 [1,0,0,0,0,0|3,0,0]=4 18 B12R1.21 CN(C)CCC1=CC=C(C=C1)O S452254 [1,0,0,0,0,0|3,0,0]=4 19 B12R1.21 NC(=O)CCC1=CC=C(C=C1)O CDS020808 [1,0,0,0,0,0|2,0,0]=3 20 B12R1.71 C=CCNC1=CC=C(C=C1)OC S340707 [1,0,0,0,0,0|2,0,1]=4 21 B12R1.71 C=CCOC1=CC=C(C=C1)OC T279811 [1,0,0,0,0,0|2,0,1]=4 22 B12R1.71 CCNCC1=CC=C(C=C1)OC PH009847 [1,0,0,0,0,0|1,0,1]=3 23 B12R1.71 [C-]#[N+]CCC1=CC=C(C=C1)OC PH015493 [1,0,0,0,0,0|2,0,1]=4 24 B14R1.2 CCC1=CC=C(C=C1)C(C)CC(=O)O T135844 [0,1,0,0,0,0|3,0,0]=4 25 B14R1.2 CCC1=CC=C(C=C1)C(N)CC(=O)O KOB0038 [0,1,0,0,0,0|3,0,0]=4 26 B14R1.2 COC1=CC=C(C=C1)C(C)CC(=O)N PH003869 [0,1,0,0,0,0|2,0,0]=3 27 B14R1.2 COC1=CC=C(C=C1)C(C)CC(=O)O R594881 [0,1,0,0,0,0|2,0,0]=3 28 B14R1.2 COC1=CC=C(C=C1)C(C)CC(=O)O R595446 [0,1,0,0,0,0|2,0,0]=3 29 B14R1.3 COC1=CC=C(C=C1)/C=C(\C)/C(=O)O PH011559 [0,1,0,0,0,0|2,0,1]=4 30 B14R1.3 COC1=CC=C(C=C1)CC(Br)C(=O)O L129216 [0,1,0,0,0,0|2,0,0]=3 31 B14R1.3 COC1=CC=C(C=C1)CN(C)C(=N)N PH014986 [0,1,0,0,0,0|3,0,0]=4 32 B14R1.5 CCC(=O)NCC1=CC=C(C=C1)OC R343323 [0,1,0,0,0,0|1,0,0]=2 33 B14R1.5 CNC(=O)OCC1=CC=C(C=C1)OC PH009130 [0,1,0,0,0,0|0,0,0]=1 34 B14R1.5 COC(=O)CCC1=CC=C(C=C1)CN CDS000982 [0,1,0,0,0,0|3,0,0]=4 35 B14R1.5 COC1=CC=C(C=C1)CCC(=O)NN CDS004132 [0,1,0,0,0,0|2,0,0]=3 36 B14R1.5 COC1=CC=C(C=C1)CNC(=O)CCl R468185 [0,1,0,0,0,0|1,0,0]=2 37 B14R1.5 COC1=CC=C(C=C1)N/N=C(/Cl)\OC S282502 [0,1,0,0,0,0|3,0,0]=4 38 B14R1.103 COC1=CC(=C(C=C1)/C=C/C(=O)O)C R411000 [0,1,0,0,0,0|2,0,1]=4 39 B14R1.103 COC1=CC=C(C(=C1)C)CCC(=O)O R238368 [0,1,0,0,0,0|2,0,0]=3 40 B14R1.142 CCOC1=CC=C(C=C1)CCC(=O)O PH011716 [0,1,0,0,0,0|2,0,0]=3 41 B14R1.211 COC1=CC=C(C=C1)CC[N+](C)(C)C S425621 [0,1,0,0,0,0|3,0,0]=4 42 B14R1.419 CC(=O)NCC1=CC=C(C=C1)B(O)O CDS005489 [0,1,0,0,0,0|3,0,0]=4 43 B14R1.419 CC(=O)OCC1=CC=C(C=C1)C(=O)O PH011524 [0,1,0,0,0,0|2,0,0]=3 44 B14R1.419 CC(=O)OCC1=CC=C(C=C1)C(=S)N BOG00235 [0,1,0,0,0,0|2,0,0]=3 45 B14R1.419 CC(=O)OCC1=CC=C(C=C1)C(C)C S528080 [0,1,0,0,0,0|1,0,0]=2 46 B14R1.419 CC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-] S562262 [0,1,0,0,0,0|2,0,0]=3 47 B14R1.419 CC(=O)O[Hg]C1=CC=C(C=C1)N(C)C S881716 [0,1,0,0,0,0|2,0,0]=3 48 B14R1.419 CN(C)C1=CC=C(C=C1)CCC(=O)O CBR00814 [0,1,0,0,0,0|3,0,0]=4 49 B14R1.3653 COC1=C(C=C(C=C1)/C=C/C(=O)O)C L134597 [0,1,0,0,0,0|2,0,1]=4 50 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)Br S102350 [0,1,0,0,0,0|2,0,0]=3 51 B14R1.3653 COC1=CC=C(C=C1C)CCC(=O)O S953792 [0,1,0,0,0,0|2,0,0]=3 52 B14R1.3653 COC1=CC=C(C=C1O)CCC(=O)O CDS006461 [0,1,0,0,0,0|2,0,0]=3 53 B14R2.134 COC1=CC2=C(C=C1)CCC(=O)O2 IDF00007 [0,0,0,1,0,0|2,0,0]=3 54 B14R2.134 COC1=CC=C2C=CC(=NC2=C1)C BBO000218 [0,0,0,1,0,0|2,0,1]=4 55 B14R2.134 COC1=CC=C2OCC(=O)NC2=C1 JRD0383 [0,0,0,1,0,0|3,0,0]=4 56 B12R1.4 CC(=O)NC1=CC=C(C=C1)CO PH010581 [0,0,0,0,1,0|3,0,0]=4 57 B12R1.4 CC(=O)NC1=CC=C(C=C1)[Hg]Cl S881155 [0,0,0,0,1,0|3,0,0]=4 58 B12R1.4 CC(=O)OC1=CC=C(C=C1)C#N PH011683 [0,0,0,0,1,0|2,0,0]=3 59 B12R1.4 CCC1=CC=C(C=C1)NC(=O)C S752002 [0,0,0,0,1,0|2,0,0]=3 60 B12R1.4 CCC1=CC=C(C=C1)NC(=O)N S639788 [0,0,0,0,1,0|3,0,0]=4 61 B12R1.4 COC1=CC=C(C=C1)CC(=N)N PH014588 [0,0,0,0,1,0|2,0,0]=3 62 B12R1.4 COC1=CC=C(C=C1)CC(=O)N S580813 [0,0,0,0,1,0|1,0,0]=2 63 B12R1.4 COC1=CC=C(C=C1)CN(C)N PH007521 [0,0,0,0,1,0|2,0,0]=3 64 B12R1.4 COC1=CC=C(C=C1)NC(=N)N S614491 [0,0,0,0,1,0|3,0,0]=4 65 B12R1.4 COC1=CC=C(C=C1)NC(=O)N S576751 [0,0,0,0,1,0|2,0,0]=3 66 B12R1.4 COC1=CC=C(C=C1)NC(=S)N S223034 [0,0,0,0,1,0|2,1,0]=4 67 B12R1.4 COC1=CC=C(C=C1)NC(C)C PH009967 [0,0,0,0,1,0|2,0,1]=4 68 B12R1.4 CSC1=CC=C(C=C1)NC(=O)C S390283 [0,0,0,0,1,0|1,1,0]=3 69 B12R1.4 CSC1=CC=C(C=C1)NC(=O)N S892882 [0,0,0,0,1,0|2,1,0]=4 70 B14R1.4 C=C(C)COCC1=CC=C(C=C1)OC T268909 [0,0,0,0,0,1|1,0,0]=2 71 B14R1.4 COC1=CC=C(C=C1)/C=N/NC(=O)C R708372 [0,0,0,0,0,1|1,0,1]=3 72 B14R1.4 COC1=CC=C(C=C1)/C=N/NC(=O)N R705640 [0,0,0,0,0,1|2,0,1]=4 73 B14R1.4 COC1=CC=C(C=C1)CCNC(=S)N PH010896 [0,0,0,0,0,1|2,1,0]=4 74 B14R1.4 COC1=CC=C(C=C1)CNNC(=S)N PH007039 [0,0,0,0,0,1|2,1,0]=4 75 B14R1.4 COC1=CC=C(C=C1)NCCN(C)C PH009971 [0,0,0,0,0,1|3,0,0]=4 76 B14R1.4 COC1=CC=C(C=C1)OCCC(=O)O S542938 [0,0,0,0,0,1|2,0,0]=3 77 B14R1.4 COC1=CC=C(C=C1)OCCN(C)C PH012069 [0,0,0,0,0,1|3,0,0]=4 78 B14R1.4 CSC1=CC=C(C=C1)CCCC(=O)O JRD0698 [0,0,0,0,0,1|2,1,0]=4 79 B11R1.1 C(=O)NNC1=CC=C(C=C1)C R751820 [2,0,0,0,0,0|2,0,0]=4 80 B11R1.1 CCCCC1=CC=C(C=C1)O CDS001507 [2,0,0,0,0,0|1,0,1]=4 81 B11R1.1 O=CCCC1=CC=C(C=C1)F CDS022638 [2,0,0,0,0,0|2,0,0]=4 82 B11R1.1 O=CCCC1=CC=C(C=C1)O CDS022892 [2,0,0,0,0,0|1,0,0]=3 83 B11R1.91 C1(C=CCC=C1)COC(=O)C T175498 [2,0,0,0,0,0|0,0,2]=4 84 B11R1.91 CC(=O)CSC1=CC=CC=C1 PH011676 [2,0,0,0,0,0|2,0,0]=4 85 B11R1.91 CC(=O)NCC1=NC=CC=C1 EME00285 [2,0,0,0,0,0|2,0,0]=4 86 B11R1.91 CC(=O)OCC1=CC=NC=C1 PH011000 [2,0,0,0,0,0|1,0,0]=3 87 B11R1.91 CC(C)OCC1=CC=CC=C1 T332682 [2,0,0,0,0,0|1,0,1]=4 88 B11R1.91 NC(=O)OCC1=CN=CC=C1 PH007236 [2,0,0,0,0,0|2,0,0]=4 89 B11R1.91 O=P(O)OCC1=CC=CC=C1 S435015 [2,0,0,0,0,0|2,0,0]=4 90 B11R1.83 CCC1=CC=C(C=C1)CNC CDS016027 [2,0,0,0,0,0|2,0,0]=4 91 B11R1.83 CCC1=CC=C(C=C1)NC=O S623113 [2,0,0,0,0,0|2,0,0]=4 92 B11R1.83 CCNC1=CC=C(C=C1)OC PH010476 [2,0,0,0,0,0|1,0,1]=4 93 B11R1.83 CNCC1=CC=C(C=C1)OC CDS003884 [2,0,0,0,0,0|1,0,0]=3 94 B11R1.83 COC1=CC=C(C=C1)CON CDS015332 [2,0,0,0,0,0|1,0,0]=3 95 B11R1.83 COC1=CC=C(C=C1)CSC S698008 [2,0,0,0,0,0|0,1,0]=3 96 B11R1.83 COCC1=CC=C(C=C1)OC S866288 [2,0,0,0,0,0|0,0,0]=2 97 B11R1.83 [C-]#[N+]CC1=CC=C(C=C1)OC PH014520 [2,0,0,0,0,0|1,0,1]=4 98 B13R1.14 CC1=CC=C(C=C1)CNC(=O)CCl TMT00603 [1,1,0,0,0,0|1,0,0]=3 99 B13R1.14 CCC(=O)C=CC1=CC=C(C=C1)C S450049 [1,1,0,0,0,0|1,0,1]=4 100 B13R1.14 CNC(=O)OCC1=CC=C(C=C1)Cl PH009074 [1,1,0,0,0,0|1,0,0]=3 101 B13R1.14 COC(=O)/C=C/C1=CC=C(C=C1)O KOB0128 [1,1,0,0,0,0|1,0,1]=4 102 B13R1.14 O=C(CCl)NCC1=CC=C(C=C1)Cl TMT00613 [1,1,0,0,0,0|2,0,0]=4 103 B13R1.14 O=C(CCl)OCC1=CC=C(C=C1)Cl S34968 [1,1,0,0,0,0|1,0,0]=3 104 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)O T135879 [1,1,0,0,0,0|2,0,0]=4 105 B13R1.132 CC1=CC=C(C=C1)C(C)CC(=O)O S326283 [1,1,0,0,0,0|2,0,0]=4 106 B13R1.133 CC(=O)C(Cl)CC1=CC=C(C=C1)Cl S567140 [1,1,0,0,0,0|2,0,0]=4 107 B13R1.133 CC(CC1=CC=C(C=C1)O)C(=O)O PH008203 [1,1,0,0,0,0|2,0,0]=4 108 B13R1.133 CC1=CC=C(C=C1)CC(C)C(=O)O R245267 [1,1,0,0,0,0|2,0,0]=4 109 B13R1.133 CC1=CC=C(C=C1)CC(N)C(=O)O PH011203 [1,1,0,0,0,0|2,0,0]=4 110 B13R1.164 CC(=O)NNC1=C(C=C(C=C1)C)N S926396 [1,1,0,0,0,0|2,0,0]=4 111 B13R1.164 CC1=CC=C(C(=C1)C)CCC(=O)O R245275 [1,1,0,0,0,0|2,0,0]=4 112 B13R1.511 CC(=O)OCC1=CC(=O)C(=CO1)O PH008620 [1,1,0,0,0,0|1,0,0]=3 113 B13R1.511 CC1=C(C=C(C=C1)CCC(=O)O)Br T303011 [1,1,0,0,0,0|2,0,0]=4 114 B13R1.5 C(=O)/C(=C/C1=CC=C(C=C1)OC)/C S941565 [1,1,0,0,0,0|1,0,1]=4 115 B13R1.371 C=CCNCC1=CC=C(C=C1)OC T286176 [1,1,0,0,0,0|1,0,1]=4 116 B13R1.371 COC1=CC=C(C=C1)CCCCBr PH007962 [1,1,0,0,0,0|1,0,1]=4 117 B13R1.371 COC1=CC=C(C=C1)CSCCN L163090 [1,1,0,0,0,0|0,1,1]=4 118 B13R1.371 COC1=CC=C(C=C1)OCCSC S697958 [1,1,0,0,0,0|2,0,0]=4 119 B13R1.452 C/C=C/C(=O)C1=CC=C(C=C1)OC PH007387 [1,1,0,0,0,0|1,0,1]=4 120 B13R1.452 CNCC(O)C1=CC=C(C=C1)OC PH015261 [1,1,0,0,0,0|2,0,0]=4 121 B13R1.452 COC1=CC=C(C=C1)[C@@H](C)N=C=O CDS019610 [1,1,0,0,0,0|1,0,1]=4 122 B13R1.4 COC1=CC=C(C=C1)CC(C)(C)Cl S128953 [0,1,0,0,1,0|1,0,1]=4 123 B13R1.4 COC1=CC=C(C=C1)CP(=O)(O)O PH002859 [0,1,0,0,1,0|2,0,0]=4 124 B13R1.35 C(=O)C1=C(C=C(C=C1)OC(=O)C)Cl R539104 [0,1,0,0,1,0|2,0,0]=4 125 B13R1.35 CCC1=C(C=C(C=C1)NC(=O)C)Br S751855 [0,1,0,0,1,0|2,0,0]=4 126 B13R1.35 CCC1=C(C=C(C=C1)NC(=O)C)Cl S752126 [0,1,0,0,1,0|2,0,0]=4 127 B13R1.35 COC1=C(C=C(C=C1)NC(=O)C)Cl S941522 [0,1,0,0,1,0|1,0,0]=3 128 B13R1.35 COC1=CC=C(C=C1Br)CC(=O)O S106569 [0,1,0,0,1,0|1,0,0]=3 129 B13R1.35 COC1=CC=C(C=C1F)CC(=N)N PH015019 [0,1,0,0,1,0|2,0,0]=4 130 B13R1.36 COC1=CC=C(C=C1)C(Br)C(=O)O PH016225 [0,1,0,0,1,0|1,0,0]=3 131 B13R1.36 COC1=CC=C(C=C1)N(C)C(=S)C S512346 [0,1,0,0,1,0|1,1,0]=4 132 B13R1.36 COC1=CC=C(C=C1)[C@@H](N)C(=O)N OMC00018 [0,1,0,0,1,0|1,0,0]=3 133 B13R1.142 CC(=O)OC1=CC=C(C=C1)/C=N/O PH002744 [0,1,0,0,1,0|2,0,0]=4 134 B13R1.142 CCCC1=CC=C(C=C1)CC(=O)C ASX00070 [0,1,0,0,1,0|1,0,0]=3 135 B13R1.142 CCCC1=CC=C(C=C1)CC(=O)O CDS018466 [0,1,0,0,1,0|2,0,0]=4 136 B13R1.142 CCOC1=CC=C(C=C1)NC(=O)N CDS021482 [0,1,0,0,1,0|2,0,0]=4 137 B13R1.585 CC(=O)NC1=CC=C(C=C1)N(C)C S875422 [0,1,0,0,1,0|2,0,0]=4 138 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)C S412341 [0,1,0,0,1,0|1,0,0]=3 139 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=S)N BOG00005 [0,1,0,0,1,0|2,0,0]=4 140 B13R1.585 CC(C)C1=CC=C(C=C1)CC(=O)O S888613 [0,1,0,0,1,0|2,0,0]=4 141 B13R1.653 COC1=CC(=C(C=C1)CC(C)Br)C S319856 [0,1,0,0,1,0|1,0,1]=4 142 B13R1.653 COC1=CC(=C(C=C1)NC(=O)C)C PH011098 [0,1,0,0,1,0|1,0,0]=3 143 B13R1.653 COC1=CC(=C(C=C1)NC(=O)C)N CDS004189 [0,1,0,0,1,0|1,0,0]=3 144 B13R1.653 COC1=CC(=C(C=C1)NC(=O)C)O S671819 [0,1,0,0,1,0|1,0,0]=3 145 B13R1.653 COC1=CC=C(C(=C1)O)CN(C)C PH019177 [0,1,0,0,1,0|2,0,0]=4 146 B15R1.1 COC1=CC=C(C=C1)COC[Si](C)(C)C T253766 [0,1,0,0,0,1|1,1,0]=4 147 B15R1.5 COC1=CC=C(C=C1)C(O)CCC(=O)O L128333 [0,1,0,0,0,1|2,0,0]=4 148 B15R1.17 CCOC1=CC=C(C=C1)/C=N/NC(=O)C R712035 [0,1,0,0,0,1|1,0,1]=4 149 B15R1.17 CCOC1=CC=C(C=C1)OCCC(=O)O PH010720 [0,1,0,0,0,1|2,0,0]=4 150 B15R1.206 C=C(CCl)COCC1=CC=C(C=C1)OC T268844 [0,1,0,0,0,1|1,0,0]=3 151 B15R1.206 CCC(=O)COCC1=CC=C(C=C1)OC T265764 [0,1,0,0,0,1|0,0,0]=2 152 B15R1.206 COC(=O)C/N=C/C1=CC=C(C=C1)OC S880604 [0,1,0,0,0,1|1,0,1]=4 153 B15R1.16 CCOC1=CC=C(C=C1)CC(N)C(=O)O PH010855 [0,2,0,0,0,0|2,0,0]=4 154 B15R1.16 CCOC1=CC=C(C=C1)C[C@@H](N)C(=O)O PH009883 [0,2,0,0,0,0|2,0,0]=4 155 B15R1.16 [C@H](N)(CC1=CC=C(C=C1)OCC)C(=O)O PH011721 [0,2,0,0,0,0|2,0,0]=4 156 B15R1.208 COC1=CC=C(C=C1)C/C(=N/O)/C(=O)O S285536 [0,2,0,0,0,0|2,0,0]=4 157 B15R1.208 COC1=CC=C(C=C1)CC(OC)C(=O)O PH018866 [0,2,0,0,0,0|2,0,0]=4 158 B15R1.216 COC1=CC=C(C=C1)CC(C)(N)C(=O)O PH004962 [0,2,0,0,0,0|2,0,0]=4 159 B15R1.793 CCCC(=O)NCC1=CC=C(C=C1)OC R343315 [0,2,0,0,0,0|1,0,0]=3 160 B15R1.793 CCCC(=O)OCC1=CC=C(C=C1)OC S679488 [0,2,0,0,0,0|0,0,0]=2 161 B15R1.793 CCOC(=O)/C=C/C1=CC=C(C=C1)OC S554189 [0,2,0,0,0,0|1,0,1]=4 162 B15R1.793 CCOC(=O)CCC1=CC=C(C=C1)OC PH000381 [0,2,0,0,0,0|1,0,0]=3 163 B15R1.793 CNCC(=O)NCC1=CC=C(C=C1)OC PH014697 [0,2,0,0,0,0|1,0,0]=3 164 B15R1.793 COC1=CC=C(C=C1)CNC(=O)CC#N R701319 [0,2,0,0,0,0|1,0,0]=3 165 B15R1.3779 COC(=O)CCC1=CC=C(C(=C1)O)OC CDS005498 [0,2,0,0,0,0|1,0,0]=3 166 B15R1.499 CC(=O)NC1=CC=C(C=C1)[Hg]OC(=O)C S417629 [0,2,0,0,0,0|2,0,0]=4 167 B15R1.499 CC(=O)NCC1=CC=C(C=C1)NC(=O)C S329185 [0,2,0,0,0,0|2,0,0]=4 168 B15R1.499 CC(=O)OC1=CC=C(C=C1)CCC(=O)O S745359 [0,2,0,0,0,0|2,0,0]=4 169 B15R1.944 COC(=O)C1=CC=C(C=C1)[Hg]OC(=O)C S882003 [0,2,0,0,0,0|1,0,0]=3 170 B15R1.498 CC(=O)OCC1=CC=C(C=C1)C(C)(C)C S240605 [0,2,0,0,0,0|1,0,0]=3 171 B15R1.12854 COC1=C(C=C(C=C1)CCC(=O)N)OC T153753 [0,2,0,0,0,0|2,0,0]=4 172 B15R1.12854 COC1=CC=C(C=C1OC)/C=C/C(=O)C S594512 [0,2,0,0,0,0|1,0,1]=4 173 B15R1.12854 COC1=CC=C(C=C1OC)CNC(=O)N PH003538 [0,2,0,0,0,0|2,0,0]=4 174 B15R1.12854 COC1=CC=C(C=C1OC)COC(=O)C PH003713 [0,2,0,0,0,0|0,0,0]=2 175 B13R2.57 COC1=CC2=C(C=C1)CNCC2 CDS005465 [1,0,0,1,0,0|1,0,1]=4 176 B13R2.57 COC1=CC=C2CNCCC2=C1 CDS002721 [1,0,0,1,0,0|1,0,1]=4 177 B13R2.669 COC1=CC2=C(C=C1)COC2=O S847151 [1,0,0,1,0,0|0,0,0]=2 178 B13R2.2121 COC1=CC2=C(C=C1)OC(=N2)C S986259 [0,0,0,1,1,0|1,0,0]=3 179 B15R2.2 COC1=CC=C(C=C1)C2CNC(=O)C2 PH009714 [0,0,0,1,0,1|1,0,0]=3 180 B15R2.2 COC1=CC=C(C=C1)[N+]2=CC(=O)O[N-]2 R761958 [0,0,0,1,0,1|1,0,1]=4 181 B15R2.4834 COC1=CC=C2OC(=CC2=C1)C(=O)C PH011148 [0,1,0,1,0,0|2,0,0]=4 182 B15R2.446 COC1=CC=C(C=C1)COC2CNC2 CDS023985 [0,1,0,1,0,0|1,0,1]=4 183 B15R2.7688 CC(=O)CCC1=CC2=C(C=C1)OCO2 R434167 [0,1,0,1,0,0|1,0,0]=3 184 B15R2.7688 CC(=O)CCC1=CC=C2OCOC2=C1 S114162 [0,1,0,1,0,0|1,0,0]=3 185 B15R2.7688 NC(=O)CCC1=CC2=C(C=C1)OCO2 T153737 [0,1,0,1,0,0|2,0,0]=4 186 B15R2.61041 CC(=O)OCC1=CC=C2CC(C2=N1)C T177229 [0,1,0,1,0,0|2,0,0]=4 187 B15R2.1824 N1C(=O)CCC2=C1C=C(C(=C2)O)OC S116890 [0,1,0,1,0,0|2,0,0]=4 188 B11R1.20 C=C(C)CC1=CC=C(C=C1)O PH007153 [1,0,0,0,1,0|1,0,0]=3 189 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl CDS004628 [1,0,0,0,1,0|1,0,0]=3 190 B11R1.20 CC(=O)CC1=CC=C(C=C1)O PH011294 [1,0,0,0,1,0|0,0,0]=2 191 B11R1.20 CC(=O)CC1=CC=C(C=N1)C CBR01484 [1,0,0,0,1,0|1,0,0]=3 192 B11R1.20 CC(=O)NC1=CC=C(C=C1)F S397075 [1,0,0,0,1,0|2,0,0]=4 193 B11R1.20 CC(=O)NC1=CC=C(C=C1)I S872970 [1,0,0,0,1,0|2,0,0]=4 194 B11R1.20 CC(=O)NC1=CC=C(C=C1)[O-] S829218 [1,0,0,0,1,0|1,0,1]=4 195 B11R1.20 CC(=O)NC1=NC=C(C=C1)C S803375 [1,0,0,0,1,0|2,0,0]=4 196 B11R1.20 CC(=O)SC1=CC=C(C=C1)C S836516 [1,0,0,0,1,0|0,1,0]=3 197 B11R1.20 CC1=CC=C(C=C1)CC(=O)Cl CDS008580 [1,0,0,0,1,0|1,0,0]=3 198 B11R1.20 CC1=CC=C(C=C1)CC(=O)N S536768 [1,0,0,0,1,0|1,0,0]=3 199 B11R1.20 CC1=CC=C(C=C1)NC(=O)N S365149 [1,0,0,0,1,0|2,0,0]=4 200 B11R1.20 CC1=CC=C(C=N1)CC(=O)O CDS019833 [1,0,0,0,1,0|2,0,0]=4 201 B11R1.20 CC1=CC=[N+](C=C1)CC(=O)N S242551 [1,0,0,0,1,0|2,0,0]=4 202 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl CDS011494 [1,0,0,0,1,0|2,0,0]=4 203 B11R1.3 CCC1=CC=C(C=C1)C(=O)N TMT00666 [0,0,0,0,2,0|2,0,0]=4 204 B11R1.3 COC1=CC=C(C=C1)C(=N)N CDS006449 [0,0,0,0,2,0|2,0,0]=4 205 B11R1.3 COC1=CC=C(C=C1)[Te](=O)Cl S50289 [0,0,0,0,2,0|2,0,0]=4 206 B11R1.3 COC1=NC=C(C=C1)C(=O)O CDS003134 [0,0,0,0,2,0|2,0,0]=4 207 B13R1.513 CC(=O)N/N=C/C1=CC=C(C=C1)C R709700 [1,0,0,0,0,1|1,0,1]=4 208 B13R1.513 CC(=O)N/N=C/C1=CC=C(C=C1)O R749648 [1,0,0,0,0,1|1,0,1]=4 209 B13R1.513 CC1=CC=C(C=C1)CCCC(=O)O S532649 [1,0,0,0,0,1|2,0,0]=4 210 B13R1.513 CC1=CC=C(C=C1)CSCC(=O)O EME00118 [1,0,0,0,0,1|1,1,0]=4 211 B13R1.643 CC(=O)OCC1=CC(=CC=C1)C#N BOG00135 [0,0,0,0,1,1|2,0,0]=4 212 B15R1.4 CCC1=CC=C(C=C1)OCCNC(=O)C R703729 [0,0,0,0,0,2|2,0,0]=4 213 B15R1.4 COC1=CC=C(C=C1)CCCCC(=O)O S126977 [0,0,0,0,0,2|2,0,0]=4 214 B15R1.4 COC1=CC=C(C=C1)OCCCC(=O)O L255203 [0,0,0,0,0,2|2,0,0]=4