0 B29R3.7163434013 CCCCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC(=C3C)C)C MCULE-9219196125 [0,0,0,0,0,0|0,0,0]=0 1 B29R3.7163434013 COCCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC(=C3C)C)C MCULE-9425629938 [0,0,0,0,0,0|1,0,0]=1 2 B28R3.1495219597 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCCCO)C MCULE-3272848103 [1,0,0,0,0,0|1,0,0]=2 3 B28R3.1495219597 CCCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC(=C3C)C)C MCULE-8976571820 [1,0,0,0,0,0|0,0,0]=1 4 B28R3.1495219597 COCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC(=C3C)C)C MCULE-6101091128 [1,0,0,0,0,0|1,0,0]=2 5 B28R3.1612333330 CCCCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC=C3C)C MCULE-5572055509 [1,0,0,0,0,0|0,0,0]=1 6 B28R3.1612333330 COCCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC=C3C)C MCULE-5383229256 [1,0,0,0,0,0|1,0,0]=2 7 B30R3.4115173382 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCCCC(=O)O)C MCULE-8416466907 [0,1,0,0,0,0|1,0,1]=3 8 B30R3.4115173382 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCCCN(C)C)C MCULE-5447847900 [0,1,0,0,0,0|1,0,0]=2 9 B30R3.9293867868 CCOCCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC(=C3C)C)C MCULE-8384405585 [0,1,0,0,0,0|0,0,0]=1 10 B30R3.11002821485 CCCCCNC(=O)CCC1=C(C2=CC3=C(OC(=C3C)C)C(=C2OC1=O)C)C MCULE-7012812753 [0,1,0,0,0,0|0,0,0]=1 11 B30R3.11002821485 COCCCNC(=O)CCC1=C(C2=CC3=C(OC(=C3C)C)C(=C2OC1=O)C)C MCULE-6398329648 [0,1,0,0,0,0|1,0,0]=2 12 B30R4.28723313 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCCCC4)C MCULE-1616473990 [0,0,0,1,0,0|0,0,0]=1 13 B30R4.28723313 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCOCC4)C MCULE-2809726065 [0,0,0,1,0,0|1,0,0]=2 14 B30R4.28723313 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCSCC4)C MCULE-2406977450 [0,0,0,1,0,0|1,0,0]=2 15 B30R4.168160151 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NC4CCCC4)C MCULE-9375378411 [0,0,0,1,0,0|0,0,0]=1 16 B27R3.490086304 CC1=COC2=C1C=C3C(=C2)OC(=O)C(=C3C)CCC(=O)NCCCO MCULE-4013724565 [2,0,0,0,0,0|1,0,0]=3 17 B27R3.490086304 CCCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC=C3C)C MCULE-2379048838 [2,0,0,0,0,0|0,0,0]=2 18 B27R3.490086304 COCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC=C3C)C MCULE-3450871412 [2,0,0,0,0,0|1,0,0]=3 19 B27R3.1162525891 C=CCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC(=C3C)C)C MCULE-4043537714 [2,0,0,0,0,0|0,0,2]=4 20 B27R3.1162525891 CCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC(=C3C)C)C MCULE-1923882816 [2,0,0,0,0,0|0,0,0]=2 21 B29R3.3491255693 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCCC(=O)O)C MCULE-4298817499 [1,1,0,0,0,0|1,0,1]=4 22 B29R3.3491255693 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCCC(C)C)C MCULE-2747471828 [1,1,0,0,0,0|0,0,0]=2 23 B29R3.3491255693 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCCN(C)C)C MCULE-8385145430 [1,1,0,0,0,0|1,0,0]=3 24 B29R3.7478024185 CC1=C(C2=C(O1)C(=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCCCO)C)C MCULE-2743996635 [1,1,0,0,0,0|1,0,0]=3 25 B29R3.7478024185 CCCCNC(=O)CCC1=C(C2=CC3=C(OC(=C3C)C)C(=C2OC1=O)C)C MCULE-8633869483 [1,1,0,0,0,0|0,0,0]=2 26 B29R3.7478024185 COCCNC(=O)CCC1=C(C2=CC3=C(OC(=C3C)C)C(=C2OC1=O)C)C MCULE-8133705573 [1,1,0,0,0,0|1,0,0]=3 27 B29R3.571629220 CCCCCNC(=O)CCC1=C(C2=CC3=C(OC=C3C)C(=C2OC1=O)C)C MCULE-6008701906 [1,1,0,0,0,0|0,0,0]=2 28 B29R3.571629220 COCCCNC(=O)CCC1=C(C2=CC3=C(OC=C3C)C(=C2OC1=O)C)C MCULE-6542610804 [1,1,0,0,0,0|1,0,0]=3 29 B29R3.2798055751 COCC(O)CNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC=C3C)C MCULE-2909457822 [1,1,0,0,0,0|1,0,0]=3 30 B29R3.3229748602 CCOCCCNC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC=C3C)C MCULE-4779365942 [1,1,0,0,0,0|0,0,0]=2 31 B29R3.8894949756 CC1=COC2=C1C=C3C(=C2)OC(=O)C(=C3C)CCC(=O)NCCCC(=O)O MCULE-9814910112 [1,1,0,0,0,0|1,0,1]=4 32 B29R3.8894949756 CC1=COC2=C1C=C3C(=C2)OC(=O)C(=C3C)CCC(=O)NCCCN(C)C MCULE-6148101946 [1,1,0,0,0,0|1,0,0]=3 33 B29R3.3491255306 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CC(=O)NCCCC(=O)O)C MCULE-4299291032 [0,1,0,0,1,0|1,0,1]=4 34 B29R3.3491255306 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CC(=O)NCCCN(C)C)C MCULE-4255052298 [0,1,0,0,1,0|1,0,0]=3 35 B29R3.7578917803 COCCCNC(=O)CC1=C(C2=CC3=C(OC(=C3C)C)C(=C2OC1=O)C)C MCULE-4184823140 [0,1,0,0,1,0|1,0,0]=3 36 B29R3.7640779566 COCC(O)CNC(=O)CC1=C(C2=CC3=C(C=C2OC1=O)OC(=C3C)C)C MCULE-7394398155 [0,1,0,0,1,0|1,0,0]=3 37 B31R3.6487812446 CC1=C(C2=C(O1)C(=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCCCC(=O)O)C)C MCULE-3737252593 [0,2,0,0,0,0|1,0,1]=4 38 B31R3.6487812446 CC1=C(C2=C(O1)C(=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCCCN(C)C)C)C MCULE-4966528262 [0,2,0,0,0,0|1,0,0]=3 39 B31R3.8041848588 CSCC[C@@H](CO)NC(=O)CCC1=C(C2=CC3=C(C=C2OC1=O)OC(=C3C)C)C MCULE-2541695806 [0,2,0,0,0,0|1,0,0]=3 40 B31R3.3255812259 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCCCOC(C)C)C MCULE-4834932533 [0,2,0,0,0,0|0,0,0]=2 41 B31R3.8077198059 CCOCCCNC(=O)CCC1=C(C2=CC3=C(OC(=C3C)C)C(=C2OC1=O)C)C MCULE-7388899284 [0,2,0,0,0,0|0,0,0]=2 42 B31R3.7929666207 COC(=O)CCNC(=O)CCC1=C(C2=CC3=C(OC(=C3C)C)C(=C2OC1=O)C)C MCULE-9473691954 [0,2,0,0,0,0|1,0,1]=4 43 B29R4.243248266 CC1=C(C2=CC3=C(C=C2O1)OC(=O)C(=C3C)CCC(=O)N4CCCC4)C MCULE-3296195714 [1,0,0,1,0,0|0,0,0]=2 44 B29R4.262235947 CC1=COC2=C1C=C3C(=C2)OC(=O)C(=C3C)CCC(=O)N4CCCCC4 MCULE-1514222284 [1,0,0,1,0,0|0,0,0]=2 45 B29R4.262235947 CC1=COC2=C1C=C3C(=C2)OC(=O)C(=C3C)CCC(=O)N4CCOCC4 MCULE-7826785946 [1,0,0,1,0,0|1,0,0]=3 46 B29R4.262235947 CC1=COC2=C1C=C3C(=C2)OC(=O)C(=C3C)CCC(=O)N4CCSCC4 MCULE-8778749495 [1,0,0,1,0,0|1,0,0]=3 47 B29R4.3710415748 CC1=COC2=C1C=C3C(=C2)OC(=O)C(=C3C)CCC(=O)NC4CCCC4 MCULE-4209123575 [1,0,0,1,0,0|0,0,0]=2 48 B29R4.33703652 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CC(=O)N4CCCCC4)C MCULE-6839291424 [0,0,0,1,1,0|0,0,0]=2 49 B29R4.33703652 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CC(=O)N4CCOCC4)C MCULE-6145366420 [0,0,0,1,1,0|1,0,0]=3 50 B29R4.33703652 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CC(=O)N4CCSCC4)C MCULE-7431065097 [0,0,0,1,1,0|1,0,0]=3 51 B31R4.678195132 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCNC(=O)C4)C MCULE-7045741652 [0,1,0,1,0,0|1,0,1]=4 52 B31R4.1459170858 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NCC4CCCO4)C MCULE-4932115321 [0,1,0,1,0,0|0,0,0]=2 53 B31R4.2381979909 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCCCCC4)C MCULE-5904971575 [0,1,0,1,0,0|0,0,0]=2 54 B31R4.46614021 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NC4CCCCC4)C MCULE-4474636599 [0,1,0,1,0,0|0,0,0]=2 55 B31R4.1458369067 CC1=C(C2=C(O1)C(=C3OC(=O)C(=C(C3=C2)C)CCC(=O)NC4CCCC4)C)C MCULE-5941481118 [0,1,0,1,0,0|0,0,0]=2 56 B31R4.1458369094 CC1=C(C2=C(O1)C(=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCCCC4)C)C MCULE-8084790804 [0,1,0,1,0,0|0,0,0]=2 57 B31R4.1458369094 CC1=C(C2=C(O1)C(=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCOCC4)C)C MCULE-6590662156 [0,1,0,1,0,0|1,0,0]=3 58 B31R4.1458369094 CC1=C(C2=C(O1)C(=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCSCC4)C)C MCULE-4638734916 [0,1,0,1,0,0|1,0,0]=3 59 B31R4.457136434 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCC(=O)CC4)C MCULE-1023353148 [0,1,0,1,0,0|0,0,1]=3 60 B31R4.457136434 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCC(CC4)C)C MCULE-4760082647 [0,1,0,1,0,0|0,0,0]=2 61 B31R4.457136434 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CCC(=O)N4CCN(CC4)C)C MCULE-3669506103 [0,1,0,1,0,0|1,0,0]=3 62 B27R3.1244587796 CC1=C(C2=C(O1)C=C3OC(=O)C(=C(C3=C2)C)CC(=O)NCCCO)C MCULE-1396582021 [1,0,0,0,1,0|1,0,0]=3 63 B27R3.1244587796 COCCNC(=O)CC1=C(C2=CC3=C(C=C2OC1=O)OC(=C3C)C)C MCULE-6908698507 [1,0,0,0,1,0|1,0,0]=3 64 B27R3.1313522180 COCCCNC(=O)CC1=C(C2=CC3=C(C=C2OC1=O)OC=C3C)C MCULE-4918164594 [1,0,0,0,1,0|1,0,0]=3