0 B24R3.8721024 COC1=C(C2=C(C=C1O)O[C@H](CC2=O)C3=CC=C(C=C3)O)O MCULE-7410807613 [0,0,0,0,0,0|0,0,2]=2 1 B24R3.8721024 COC1=C(C=C2OC(=CC(=O)C2=C1O)C3=CC=C(C=C3)O)O MCULE-3882973229 [0,0,0,0,0,0|0,0,0]=0 2 B24R3.8721024 COC1=C(C=C2O[C@@H](CC(=O)C2=C1O)C3=CC=C(C=C3)O)O MCULE-4193299594 [0,0,0,0,0,0|0,0,2]=2 3 B24R3.8721024 COC1=C(C=C2O[C@@H](CC(=O)C2=C1O)C3=CC=C(C=C3)O)O MCULE-6749012516 [0,0,0,0,0,0|0,0,2]=2 4 B23R3.1580940 COC1=C(C2=C(C=C1)NC(=CC2=O)C3=CC=C(C=C3)F)O MCULE-3153620487 [1,0,0,0,0,0|2,0,0]=3 5 B23R3.2128607 COC1=C(C=C2OC(=CC(=O)C2=C1O)C3=CC=CC=C3)O MCULE-2436656462 [1,0,0,0,0,0|0,0,0]=1 6 B23R3.2128607 COC1=C(C=C2OC(CC(=O)C2=C1O)C3=CC=CC=C3)O MCULE-9660679251 [1,0,0,0,0,0|0,0,2]=3 7 B23R3.2128607 COC1=C(C=C2O[C@@H](CC(=O)C2=C1O)C3=CC=CC=C3)O MCULE-3601358321 [1,0,0,0,0,0|0,0,2]=3 8 B23R3.2128607 COC1=C(C=C2O[C@@H](CC(=O)C2=C1O)C3=CC=CC=C3)O MCULE-8853671346 [1,0,0,0,0,0|0,0,2]=3 9 B23R3.71772102 CC1=C(C=C2OC(CC(=O)C2=C1O)C3=CC=C(C=C3)O)O MCULE-7104867839 [1,0,0,0,0,0|0,0,2]=3 10 B23R3.71772102 CC1=C(C=C2O[C@@H](CC(=O)C2=C1O)C3=CC=C(C=C3)O)O MCULE-3686751041 [1,0,0,0,0,0|0,0,2]=3 11 B23R3.71772102 O=C1C=C(OC2=CC(=C(C(=C12)O)O)O)C3=CC=C(C=C3)O MCULE-9663785400 [1,0,0,0,0,0|0,0,0]=1 12 B25R3.2391652 COC1=C(C2=C(C=C1O)OC(=C(C2=O)O)C3=CC=C(C=C3)O)O MCULE-8615505233 [0,1,0,0,0,0|0,0,0]=1 13 B25R3.10796687 COC1=C(C=C2OC(=CC(=O)C2=C1O)C3=CC(=C(C=C3)O)O)O MCULE-7564407072 [0,1,0,0,0,0|0,0,0]=1 14 B25R3.12557951 COC1=C(C(=C2C(=O)C=C(OC2=C1)C3=CC=C(C=C3)O)O)OC MCULE-1790924522 [0,1,0,0,0,0|0,0,0]=1 15 B25R3.140238825 COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C(=C3O)OC)O MCULE-6892406702 [0,1,0,0,0,0|0,0,0]=1 16 B25R3.110417472 COC1=C(C=C2OC(=CC(=O)C2=C1O)OC3=CC=C(C=C3)O)O MCULE-4075057566 [0,0,0,0,0,1|0,0,0]=1 17 B22R3.1186113 COC1=CC2=C(C=C1)OC(=CC2=O)C3=CC=C(C=C3)Br MCULE-2095125640 [2,0,0,0,0,0|1,0,0]=3 18 B22R3.1186113 COC1=CC2=C(C=C1)OC(=CC2=O)C3=CC=C(C=C3)Cl MCULE-3017910956 [2,0,0,0,0,0|1,0,0]=3 19 B22R3.1186113 COC1=CC2=C(C=C1)OC(=CC2=O)C3=CC=C(C=C3)F MCULE-5699481483 [2,0,0,0,0,0|1,0,0]=3 20 B22R3.1186113 COC1=CC=C2OC(=CC(=O)C2=C1)C3=CC=C(C=C3)C MCULE-5527560907 [2,0,0,0,0,0|1,0,0]=3 21 B22R3.1186113 COC1=CC=C2OC(=CC(=O)C2=C1)C3=CC=C(C=C3)N MCULE-3450488165 [2,0,0,0,0,0|1,0,0]=3 22 B22R3.2846088 O=C1C=C(OC2=CC(=C(C(=C12)O)O)O)C3=CC=CC=C3 MCULE-8669340472 [2,0,0,0,0,0|0,0,0]=2 23 B22R3.2846088 O=C1CC(OC2=CC(=C(C(=C12)O)O)O)C3=CC=CC=C3 MCULE-9153751111 [2,0,0,0,0,0|0,0,2]=4 24 B22R3.2846088 O=C1C[C@H](OC2=CC(=C(C(=C12)O)O)O)C3=CC=CC=C3 MCULE-6923632463 [2,0,0,0,0,0|0,0,2]=4 25 B22R3.15233977 O=C1CC(OC2=C1C=C(C(=C2)O)O)C3=CC=C(C=C3)O MCULE-3401471627 [2,0,0,0,0,0|0,0,2]=4 26 B22R3.98287844 O=C1C=C(OC2=C1C(=CC(=C2)O)O)C3=CC=C(C=C3)O MCULE-6141069907 [2,0,0,0,0,0|0,0,0]=2 27 B22R3.98287844 O=C1CC(OC2=C1C(=CC(=C2)O)O)C3=CC=C(C=C3)O MCULE-5489217450 [2,0,0,0,0,0|0,0,2]=4 28 B22R3.98287844 O=C1C[C@@H](OC2=C1C(=CC(=C2)O)O)C3=CC=C(C=C3)O MCULE-3254872691 [2,0,0,0,0,0|0,0,2]=4 29 B22R3.98287844 O=C1C[C@@H](OC2=C1C(=CC(=C2)O)O)C3=CC=C(C=C3)O MCULE-5852778653 [2,0,0,0,0,0|0,0,2]=4 30 B22R3.98287844 O=C1C[C@H](OC2=CC(=CC(=C12)O)O)C3=CC=C(C=C3)O MCULE-2527326110 [2,0,0,0,0,0|0,0,2]=4 31 B22R3.98287844 O=C1C[C@H](OC2=CC(=CC(=C12)O)O)C3=CC=C(C=C3)O MCULE-4005429744 [2,0,0,0,0,0|0,0,2]=4 32 B24R3.1438136 COC1=C(C2=C(C=C1)NC(=CC2=O)C3=CC=C(C=C3)F)OC MCULE-1270382146 [1,1,0,0,0,0|2,0,0]=4 33 B24R3.10522448 COC1=C(C(=C2C(=O)C=C(OC2=C1)C3=CC=CC=C3)O)OC MCULE-5911493067 [1,1,0,0,0,0|0,0,0]=2 34 B24R3.10522448 COC1=C(C(=C2C(=O)C[C@H](OC2=C1)C3=CC=CC=C3)O)OC MCULE-2232530891 [1,1,0,0,0,0|0,0,2]=4 35 B24R3.1012910 O=C1C(=C(OC2=CC(=C(C(=C12)O)O)O)C3=CC=C(C=C3)O)O MCULE-7066141394 [1,1,0,0,0,0|0,0,0]=2 36 B24R3.10522450 COC1=C(C(=C2C(=O)C=C(OC2=C1)C3=CC=C(C=C3)O)O)C MCULE-6173603656 [1,1,0,0,0,0|0,0,0]=2 37 B24R3.10522450 COC1=C(C(=C2C(=O)C[C@H](OC2=C1)C3=CC=C(C=C3)O)O)C MCULE-2369804832 [1,1,0,0,0,0|0,0,2]=4 38 B24R3.10522450 COC1=C(C(=C2C(=O)C[C@H](OC2=C1)C3=CC=C(C=C3)O)O)C MCULE-4107309014 [1,1,0,0,0,0|0,0,2]=4 39 B24R3.13273904 COC1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)O)O)O MCULE-4215154924 [1,1,0,0,0,0|0,0,0]=2 40 B24R3.311191956 CC1=C(C(=C2OC(=CC(=O)C2=C1O)C3=CC=C(C=C3)O)C)O MCULE-4358546433 [1,1,0,0,0,0|0,0,0]=2 41 B24R3.311191956 CC1=C(C(=C2OC(CC(=O)C2=C1O)C3=CC=C(C=C3)O)C)O MCULE-5001672302 [1,1,0,0,0,0|0,0,2]=4 42 B24R3.311191956 CC1=C(C(=C2O[C@@H](CC(=O)C2=C1O)C3=CC=C(C=C3)O)C)O MCULE-6580599773 [1,1,0,0,0,0|0,0,2]=4 43 B24R3.311191956 CC1=C(C(=C2O[C@@H](CC(=O)C2=C1O)C3=CC=C(C=C3)O)C)O MCULE-9917900371 [1,1,0,0,0,0|0,0,2]=4 44 B26R3.2546025 COC1=C(C2=C(C=C1O)OC(=C(C2=O)O)C3=CC(=C(C=C3)O)O)O MCULE-5009949604 [0,2,0,0,0,0|0,0,0]=2 45 B26R3.13735978 COC1=C(C=C2OC(=C(C(=O)C2=C1O)OC)C3=CC=C(C=C3)O)O MCULE-8905546954 [0,2,0,0,0,0|0,0,0]=2 46 B26R3.138417696 COC1=C(C(=C2C(=O)C=C(OC2=C1)C3=CC(=C(C=C3)O)O)O)OC MCULE-9854332110 [0,2,0,0,0,0|0,0,0]=2 47 B26R3.2138038067 COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)O)OC)O)O MCULE-1319328052 [0,2,0,0,0,0|0,0,0]=2 48 B26R3.2197070572 COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)O)OC)O)O MCULE-8869838096 [0,2,0,0,0,0|0,0,0]=2 49 B26R3.126952979 COC1=C(C(=C2C(=O)C=C(OC2=C1O)C3=CC=C(C=C3)O)O)OC MCULE-9454632534 [0,2,0,0,0,0|0,0,0]=2 50 B26R3.172756228 COC1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)O MCULE-1143563858 [0,2,0,0,0,0|0,0,0]=2 51 B24R4.3648882 O=C1C=C(OC2=CC3=C(OCO3)C(=C12)O)C4=CC=CC=C4 MCULE-5287843253 [1,0,0,1,0,0|0,0,0]=2 52 B24R3.7724733 COC1=C(C=C2OC=C(C(=O)C2=C1O)C3=CC=C(C=C3)O)O MCULE-2089260732 [0,0,0,0,1,1|0,0,0]=2