0 B24R3.1245441990 COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3O)O)O MCULE-4793583546 [0,0,0,0,0,0|0,0,2]=2 1 B24R3.1245441990 COC1=C(C=C(C=C1)C2CC(=O)C3=C(C=C(C=C3O2)O)O)O MCULE-9396529091 [0,0,0,0,0,0|0,0,0]=0 2 B24R3.1245441990 COC1=C(C=C(C=C1)C2CC(=O)C3=C(O2)C=C(C=C3O)O)O MCULE-9044534531 [0,0,0,0,0,0|0,0,0]=0 3 B24R3.1245441990 COC1=C(C=C(C=C1)[C@@H]2CC(=O)C3=C(C=C(C=C3O2)O)O)O MCULE-2028448851 [0,0,0,0,0,0|0,0,0]=0 4 B24R3.1245441990 COC1=C(C=C(C=C1)[C@@H]2CC(=O)C3=C(O2)C=C(C=C3O)O)O MCULE-7131810532 [0,0,0,0,0,0|0,0,0]=0 5 B24R3.1245441990 COC1=CC=C(C=C1O)[C@H]2CC(=O)C3=C(C=C(C=C3O2)O)O MCULE-2236290715 [0,0,0,0,0,0|0,0,0]=0 6 B23R3.9068341 COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O MCULE-8773156096 [1,0,0,0,0,0|0,0,2]=3 7 B23R3.9068341 COC1=CC=C(C=C1)C2CC(=O)C3=C(O2)C=C(C=C3C)C MCULE-1651216901 [1,0,0,0,0,0|2,0,0]=3 8 B23R3.9068341 COC1=CC=C(C=C1)C2CC(=O)C3=C(O2)C=C(C=C3O)O MCULE-9439004515 [1,0,0,0,0,0|0,0,0]=1 9 B23R3.9068341 COC1=CC=C(C=C1)[C@@H]2CC(=O)C3=C(C=C(C=C3O2)O)O MCULE-7578970975 [1,0,0,0,0,0|0,0,0]=1 10 B23R3.9068341 COC1=CC=C(C=C1)[C@@H]2CC(=O)C3=C(O2)C=C(C=C3O)O MCULE-6964743359 [1,0,0,0,0,0|0,0,0]=1 11 B23R3.184688319 O=C1C=C(OC2=CC(=CC(=C12)O)O)C3=CC=C(C(=C3)O)O MCULE-6874646775 [1,0,0,0,0,0|0,0,2]=3 12 B23R3.184688319 O=C1CC(OC2=CC(=CC(=C12)O)O)C3=CC(=C(C=C3)O)O MCULE-8678602121 [1,0,0,0,0,0|0,0,0]=1 13 B23R3.184688319 O=C1C[C@H](OC2=C1C(=CC(=C2)O)O)C3=CC=C(C(=C3)O)O MCULE-3225229511 [1,0,0,0,0,0|0,0,0]=1 14 B23R3.184688319 O=C1C[C@H](OC2=CC(=CC(=C12)O)O)C3=CC=C(C(=C3)O)O MCULE-1688833251 [1,0,0,0,0,0|0,0,0]=1 15 B23R3.289360638 COC1=CC=C(C=C1O)C2CC3=C(C(=O)O2)C(=CC=C3)O MCULE-1429630102 [1,0,0,0,0,0|2,0,0]=3 16 B23R3.289360638 COC1=CC=C(C=C1O)[C@@H]2CC3=C(C(=O)O2)C(=CC=C3)O MCULE-2545751883 [1,0,0,0,0,0|2,0,0]=3 17 B23R3.289360638 COC1=CC=C(C=C1O)[C@@H]2CC3=C(C(=O)O2)C(=CC=C3)O MCULE-5568086321 [1,0,0,0,0,0|2,0,0]=3 18 B23R3.289360638 COC1=CC=C(C=C1O)[C@H]2CC3=C(C(=O)O2)C(=CC=C3)O MCULE-3216429743 [1,0,0,0,0,0|2,0,0]=3 19 B23R3.289360638 COC1=CC=C(C=C1O)[C@H]2CC3=C(C(=O)O2)C(=CC=C3)O MCULE-4429228961 [1,0,0,0,0,0|2,0,0]=3 20 B25R3.1196100423 COC1=CC=C(C=C1OC)C2=CC(=O)C3=C(C=C(C=C3O2)O)O MCULE-2885769977 [0,1,0,0,0,0|0,0,2]=3 21 B25R3.1196228775 COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3O)O)O)O MCULE-8124433804 [0,1,0,0,0,0|0,0,2]=3 22 B25R3.1196228775 COC1=C(C=C(C=C1)[C@H]2OC3=CC(=CC(=C3C(=O)[C@@H]2O)O)O)O MCULE-1856015315 [0,1,0,0,0,0|0,0,0]=1 23 B25R3.1196228775 COC1=CC=C(C=C1O)[C@H]2OC3=CC(=CC(=C3C(=O)[C@@H]2O)O)O MCULE-2569021361 [0,1,0,0,0,0|0,0,0]=1 24 B25R3.1196288656 COC1=CC(=C2C(=O)C=C(OC2=C1)C3=CC=C(C(=C3)O)OC)O MCULE-5499691249 [0,1,0,0,0,0|0,0,2]=3 25 B25R3.1196288656 COC1=CC(=C2C(=O)C[C@H](OC2=C1)C3=CC(=C(C=C3)OC)O)O MCULE-5463631459 [0,1,0,0,0,0|0,0,0]=1 26 B25R3.1196288656 COC1=CC(=C2C(=O)C[C@H](OC2=C1)C3=CC=C(C(=C3)O)OC)O MCULE-7506857470 [0,1,0,0,0,0|0,0,0]=1 27 B23R2.22678440 COC1=C(C=C(C=C1)CCC(=O)C2=C(C=C(C=C2O)O)O)O MCULE-3800082945 [0,0,1,0,0,0|0,0,0]=1 28 B22R2.3175459 COC1=C(C=C(C=C1)C=CC(=O)C2=C(C=C(C=C2)O)O)O MCULE-8634962674 [1,0,1,0,0,0|0,0,2]=4 29 B22R2.177013 CCC1=CC=C(C=C1)OCC(=O)C2=C(C=C(C=C2O)O)O MCULE-5770251395 [1,0,1,0,0,0|2,0,0]=4 30 B22R2.177013 COC1=CC=C(C=C1)CCC(=O)C2=C(C=C(C=C2O)O)O MCULE-4928159493 [1,0,1,0,0,0|0,0,0]=2 31 B22R2.177013 COC1=CC=C(C=C1)OCC(=O)C2=C(C=C(C=C2O)O)O MCULE-7652263813 [1,0,1,0,0,0|1,0,0]=3 32 B22R2.8237677 O=C(C=CC1=CC=C(C(=C1)O)O)C2=C(C=C(C=C2O)O)O MCULE-7223751674 [1,0,1,0,0,0|0,0,2]=4 33 B22R2.8237677 O=C(CCC1=CC=C(C(=C1)O)O)C2=C(C=C(C=C2O)O)O MCULE-2611846879 [1,0,1,0,0,0|0,0,0]=2 34 B22R3.294781 COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3)O MCULE-4757451306 [2,0,0,0,0,0|0,0,2]=4 35 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|0,0,2]=4 36 B22R3.98287844 O=C1CC(OC2=C1C(=CC(=C2)O)O)C3=CC=C(C=C3)O MCULE-5489217450 [2,0,0,0,0,0|0,0,0]=2 37 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|0,0,0]=2 38 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|0,0,0]=2 39 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|0,0,0]=2 40 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|0,0,0]=2 41 B22R3.98287844 O=C1OC(CC2=CC(=CC(=C12)O)O)C3=CC=C(C=C3)O MCULE-1154941681 [2,0,0,0,0,0|2,0,0]=4 42 B22R3.3096840 COC1=C(C=C(C=C1)[C@@H]2CCC3=CC=C(C=C3O2)O)O MCULE-8583168504 [2,0,0,0,0,0|0,0,1]=3 43 B22R3.3096840 COC1=CC=C(C=C1O)[C@@H]2CCC3=CC=C(C=C3O2)O MCULE-4075275973 [2,0,0,0,0,0|0,0,1]=3 44 B22R3.3097244 COC1=C(C=C(C=C1)C2NC(=O)C3=C(N2)C=CC=C3)O MCULE-3472953049 [2,0,0,0,0,0|2,0,0]=4 45 B22R3.11067224 O=C1C=C(OC2=CC(=CC=C12)O)C3=CC(=C(C=C3)O)O MCULE-1703428892 [2,0,0,0,0,0|0,0,2]=4 46 B22R3.11067224 O=C1CC(OC2=CC(=CC=C12)O)C3=CC(=C(C=C3)O)O MCULE-9899038190 [2,0,0,0,0,0|0,0,0]=2 47 B22R3.11067224 O=C1C[C@@H](OC2=CC(=CC=C12)O)C3=CC(=C(C=C3)O)O MCULE-7325583953 [2,0,0,0,0,0|0,0,0]=2 48 B22R3.11067224 O=C1C[C@H](OC2=CC(=CC=C12)O)C3=CC(=C(C=C3)O)O MCULE-1131774635 [2,0,0,0,0,0|0,0,0]=2 49 B22R3.11067224 O=C1C[C@H](OC2=CC(=CC=C12)O)C3=CC=C(C(=C3)O)O MCULE-4326903332 [2,0,0,0,0,0|0,0,0]=2 50 B22R3.10328943 O=C1C=C(OC2=C1C(=CC=C2)O)C3=CC(=C(C=C3)O)O MCULE-9735301384 [2,0,0,0,0,0|0,0,2]=4 51 B24R3.13139879 COC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3O)O)O MCULE-9836342232 [1,1,0,0,0,0|0,0,2]=4 52 B24R3.13272581 COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC)O MCULE-9699889328 [1,1,0,0,0,0|0,0,2]=4 53 B24R3.13272581 COC1=CC=C(C=C1)C2CC(=O)C3=C(O2)C=C(C=C3O)OC MCULE-6759485524 [1,1,0,0,0,0|0,0,0]=2 54 B24R3.13272581 COC1=CC=C(C=C1)[C@@H]2CC(=O)C3=C(C=C(C=C3O2)OC)O MCULE-2862082028 [1,1,0,0,0,0|0,0,0]=2 55 B24R3.13272581 COC1=CC=C(C=C1)[C@@H]2CC(=O)C3=C(O2)C=C(C=C3O)OC MCULE-4519786540 [1,1,0,0,0,0|0,0,0]=2 56 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|0,0,2]=4 57 B24R3.132789761 COC1=CC=C(C=C1)C2CC(=O)C3=C(O2)C=C(C=C3OC)O MCULE-3988050671 [1,1,0,0,0,0|0,0,0]=2 58 B24R3.132789761 COC1=CC=C(C=C1)[C@@H]2CC(=O)C3=C(C=C(C=C3O2)O)OC MCULE-2855478624 [1,1,0,0,0,0|0,0,0]=2 59 B24R3.132789761 COC1=CC=C(C=C1)[C@@H]2CC(=O)C3=C(C=C(C=C3O2)O)OC MCULE-7928364382 [1,1,0,0,0,0|0,0,0]=2 60 B24R3.45751963 COC1=CC(=CC2=C1C(=O)C=C(O2)C3=CC=C(C(=C3)O)O)O MCULE-1442808828 [1,1,0,0,0,0|0,0,2]=4 61 B24R3.311572219 O=C1C(=C(OC2=C1C(=CC(=C2)O)O)C3=CC(=C(C=C3)O)O)O MCULE-2433372790 [1,1,0,0,0,0|0,0,2]=4 62 B24R3.311572219 O=C1C2=C(C=C(C=C2O)O)OC(C1O)C3=CC(=C(C=C3)O)O MCULE-4254870575 [1,1,0,0,0,0|0,0,0]=2 63 B24R3.311572219 O=C1C2=C(C=C(C=C2O)O)O[C@@H]([C@H]1O)C3=CC(=C(C=C3)O)O MCULE-2394173874 [1,1,0,0,0,0|0,0,0]=2 64 B24R3.311572219 O=C1C2=C(C=C(C=C2O)O)O[C@@H]([C@H]1O)C3=CC(=C(C=C3)O)O MCULE-2692728789 [1,1,0,0,0,0|0,0,0]=2 65 B24R3.311572219 O=C1C2=C(C=C(C=C2O)O)O[C@H]([C@@H]1O)C3=CC(=C(C=C3)O)O MCULE-4871721304 [1,1,0,0,0,0|0,0,0]=2 66 B24R3.311572219 O=C1C2=C(C=C(C=C2OC([C@H]1O)C3=CC(=C(C=C3)O)O)O)O MCULE-2009062312 [1,1,0,0,0,0|0,0,0]=2 67 B24R3.311572219 O=C1C2=C(C=C(C=C2OC([C@H]1O)C3=CC(=C(C=C3)O)O)O)O MCULE-9493140071 [1,1,0,0,0,0|0,0,0]=2 68 B24R3.311572219 OC1=CC(=C2C(=C1)OC(C(C2O)O)C3=CC(=C(C=C3)O)O)O MCULE-5985056481 [1,1,0,0,0,0|0,0,2]=4 69 B24R3.311572219 OC1=CC(=C2C(=C1)O[C@@H]([C@H](C2O)O)C3=CC=C(C(=C3)O)O)O MCULE-4332418172 [1,1,0,0,0,0|0,0,2]=4 70 B24R3.311572219 OC1=CC2=C(C(=C1)O)C([C@@H]([C@H](O2)C3=CC=C(C(=C3)O)O)O)O MCULE-6269704449 [1,1,0,0,0,0|0,0,2]=4 71 B24R3.337791963 COC1=CC(=C2C(=O)C=C(OC2=C1)C3=CC(=C(C=C3)O)O)O MCULE-7964905907 [1,1,0,0,0,0|0,0,2]=4 72 B24R3.337791963 COC1=CC(=C2C(=O)CC(OC2=C1)C3=CC(=C(C=C3)O)O)O MCULE-2703837005 [1,1,0,0,0,0|0,0,0]=2 73 B24R3.337791963 COC1=CC(=C2C(=O)C[C@H](OC2=C1)C3=CC=C(C(=C3)O)O)O MCULE-1942869895 [1,1,0,0,0,0|0,0,0]=2 74 B24R3.337791963 COC1=CC(=C2C(=O)C[C@H](OC2=C1)C3=CC=C(C(=C3)O)O)O MCULE-4928479927 [1,1,0,0,0,0|0,0,0]=2 75 B24R3.557722971 O=C1C=C(OC2=C1C(=CC(=C2)O)O)C3=CC(=C(C(=C3)O)O)O MCULE-5962995471 [1,1,0,0,0,0|0,0,2]=4 76 B24R3.1289013967 COC1=CC(=CC=C1O)C2=CC(=O)C3=C(C=C(C=C3O2)O)O MCULE-7873890076 [1,1,0,0,0,0|0,0,2]=4 77 B24R3.1289013967 COC1=CC(=CC=C1O)C2CC(=O)C3=C(C=C(C=C3O2)O)O MCULE-3324355674 [1,1,0,0,0,0|0,0,0]=2 78 B24R3.1289013967 COC1=CC(=CC=C1O)C2CC(=O)C3=C(O2)C=C(C=C3O)[O-] MCULE-7813766440 [1,1,0,0,0,0|0,0,1]=3 79 B24R3.1289013967 COC1=CC(=CC=C1O)[C@@H]2CC(=O)C3=C(C=C(C=C3O2)O)O MCULE-2197237863 [1,1,0,0,0,0|0,0,0]=2 80 B24R3.1289013967 COC1=CC(=CC=C1O)[C@@H]2CC(=O)C3=C(C=C(C=C3O2)O)O MCULE-9587381415 [1,1,0,0,0,0|0,0,0]=2 81 B24R3.3360687369 O=C1C=C(OC2=CC(=CC(=C12)O)O)C3=CC(=C(C=C3O)O)O MCULE-7378945518 [1,1,0,0,0,0|0,0,2]=4 82 B24R3.1245347844 COC1=CC=C(C=C1OC)C2CC3=C(C(=O)O2)C(=CC=C3)O MCULE-1802836672 [1,1,0,0,0,0|2,0,0]=4 83 B26R3.1273258667 COC1=CC=C(C=C1OC)C2=C(C(=O)C3=C(O2)C=C(C=C3O)O)O MCULE-5654180771 [0,2,0,0,0,0|0,0,2]=4 84 B26R3.1273312158 COC1=CC(=C2C(=O)C=C(OC2=C1)C3=CC(=C(C=C3)OC)OC)O MCULE-7404047073 [0,2,0,0,0,0|0,0,2]=4 85 B26R3.1273312158 COC1=CC(=C2C(=O)C[C@H](OC2=C1)C3=CC=C(C(=C3)OC)OC)O MCULE-5175301959 [0,2,0,0,0,0|0,0,0]=2 86 B26R3.1887562041 COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)OC)OC MCULE-9665352948 [0,2,0,0,0,0|0,0,2]=4 87 B26R3.1273541081 COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC)O MCULE-6705029917 [0,2,0,0,0,0|0,0,2]=4 88 B26R3.2137914708 COC1=CC(=C2C(=O)C(=C(OC2=C1)C3=CC(=C(C=C3)OC)O)O)O MCULE-1590804124 [0,2,0,0,0,0|0,0,2]=4 89 B26R3.2137914708 COC1=CC(=C2C(=O)[C@@H]([C@H](OC2=C1)C3=CC(=C(C=C3)OC)O)O)O MCULE-8224104004 [0,2,0,0,0,0|0,0,0]=2 90 B26R3.2137914708 COC1=CC(=C2C(=O)[C@@H]([C@H](OC2=C1)C3=CC=C(C(=C3)O)OC)O)O MCULE-9938159782 [0,2,0,0,0,0|0,0,0]=2 91 B26R3.2332029635 COC1=C(C=C(C=C1O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O MCULE-9340549850 [0,2,0,0,0,0|0,0,2]=4 92 B26R3.2241907815 COC1=CC2=C(C(=O)C=C(O2)C3=CC=C(C(=C3)O)OC)C(=C1)OC MCULE-5552646317 [0,2,0,0,0,0|0,0,2]=4 93 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|0,0,2]=4 94 B24R3.61782701 COC1=CC=C(C=C1O)C2=COC3=C(C2=O)C(=CC(=C3)O)O MCULE-3233025251 [0,0,0,0,1,1|0,0,1]=3