0 B24R3.246747273 CC(=O)OCC(O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_200000139349 [0,0,0,0,0,0|3,0,1]=4 1 B24R3.246747273 CC(=O)OCC(O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_200000139349 [0,0,0,0,0,0|3,0,1]=4 2 B23R3.19222387 CC(C)CCCCNc1cccc2c1c3c(o2)cccc3 34a_100009830322_100011216152 [1,0,0,0,0,0|3,0,0]=4 3 B23R3.19222387 CC(C)CCCCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_100011216152 [1,0,0,0,0,0|2,0,0]=3 4 B23R3.19222387 CC(C)CCCCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100011216152 [1,0,0,0,0,0|2,0,0]=3 5 B23R3.19222387 CC(C)CCCCSc1cccc2c1c3c([nH]2)ccnc3 62a_100011216152_200037665351 [1,0,0,0,0,0|2,1,0]=4 6 B25R3.230570337 CC(C)N(C)CC(O)COc1cccc2c1c3c([nH]2)cccc3 2230a_200000032585_200000210301 [0,1,0,0,0,0|0,0,0]=1 7 B25R3.230570337 CC(C)N(C)CC(O)COc1cccc2c1c3c([nH]2)cccc3 269982a_200000032585_200000210301 [0,1,0,0,0,0|0,0,0]=1 8 B25R3.230570337 CC(C)N([13CH3])CC(O)COc1cccc2c1c3c([nH]2)cccc3 2230a_200000032585_200025704644 [0,1,0,0,0,0|0,0,0]=1 9 B25R3.230570337 CC(C)N([13CH3])CC(O)COc1cccc2c1c3c([nH]2)cccc3 269982a_200000032585_200025704644 [0,1,0,0,0,0|0,0,0]=1 10 B23R2.186976 CC(=O)OCC(O)COc1cccc(c1)Nc2ccccc2 34a_100000031534_200000139349 [0,0,1,0,0,0|2,0,1]=4 11 B23R2.186976 CC(=O)OCC(O)COc1cccc(c1)Nc2ccccc2 7a_100000031534_200000139349 [0,0,1,0,0,0|2,0,1]=4 12 B25R4.203466697 CC1(OCC(O1)CSc2cccc3c2c4c([nH]3)ccnc4)C 62a_100000198056_200037665351 [0,0,0,1,0,0|2,1,0]=4 13 B25R4.203466697 CC1(OC[C@@H](O1)COc2cccc3c2c4c(o3)cccc4)C 7a_100010256132_100015422573 [0,0,0,1,0,0|2,0,0]=3 14 B25R4.203466697 CC1(OC[C@@H](O1)CSc2cccc3c2c4c([nH]3)ccnc4)C 62a_100015422573_200037665351 [0,0,0,1,0,0|2,1,0]=4 15 B23R3.41928238 CC(C)CCC(C)Oc1cccc2c1c3c(o2)cccc3 34a_100010256132_100011261404 [0,0,0,0,1,0|3,0,0]=4 16 B23R3.150480128 CC(C)NC(=O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000183996 [0,0,0,0,1,0|1,0,2]=4 17 B23R3.150480128 CC(C)NC(=O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000183996 [0,0,0,0,1,0|1,0,2]=4 18 B23R3.150480128 CC(COc1cccc2c1c3c(o2)cccc3)CN(C)C 7a_100010256132_100015348159 [0,0,0,0,1,0|3,0,0]=4 19 B22R2.4636 Cc1ccccc1c2ccccc2OCCCCC(C)C 34a_200011997984_100011216152 [1,0,1,0,0,0|2,0,0]=4 20 B22R2.4636 Cc1ccccc1c2ccccc2OCCCCC(C)C 7a_200011997984_100011216152 [1,0,1,0,0,0|2,0,0]=4 21 B22R2.15285 CC(C)CCCCOc1cccc(c1)Cc2ccccc2 34a_100000073777_100011216152 [1,0,1,0,0,0|2,0,0]=4 22 B22R2.15285 CC(C)CCCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100011216152 [1,0,1,0,0,0|2,0,0]=4 23 B22R2.15285 CC(C)CCCCOc1cccc(c1)Nc2ccccc2 34a_100000031534_100011216152 [1,0,1,0,0,0|1,0,0]=3 24 B22R2.15285 CC(C)CCCCOc1cccc(c1)Nc2ccccc2 7a_100000031534_100011216152 [1,0,1,0,0,0|1,0,0]=3 25 B22R2.15285 CC(C)CCCCOc1cccc(c1)Oc2ccccc2 7a_100000199087_100011216152 [1,0,1,0,0,0|2,0,0]=4 26 B22R3.3428974 CCCCCCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000210314 [2,0,0,0,0,0|2,0,0]=4 27 B22R3.3428974 CCCCCCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000210314 [2,0,0,0,0,0|2,0,0]=4 28 B22R3.3428974 CCOCCCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_100012232248 [2,0,0,0,0,0|2,0,0]=4 29 B22R3.3428974 CCOCCCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100012232248 [2,0,0,0,0,0|2,0,0]=4 30 B22R3.2209667 CCCC(C)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100011216630 [2,0,0,0,0,0|2,0,0]=4 31 B22R3.2209667 CCCC(C)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100011216630 [2,0,0,0,0,0|2,0,0]=4 32 B22R3.2209667 COCC(O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100011215053 [2,0,0,0,0,0|2,0,0]=4 33 B22R3.2209667 COCC(O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100011215053 [2,0,0,0,0,0|2,0,0]=4 34 B24R3.334883130 CC(C)NC(=O)CCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000737564 [1,1,0,0,0,0|1,0,1]=4 35 B24R3.28934169 C[N+](C)(C)CC(O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000032816 [0,1,0,0,1,0|2,0,0]=4 36 B24R3.28934169 C[N+](C)(C)CC(O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000032816 [0,1,0,0,1,0|2,0,0]=4 37 B26R3.39898487 CC(C)N(CF)CC(O)COc1cccc2c1c3c([nH]2)cccc3 269982a_200000032585_100015361967 [0,2,0,0,0,0|0,0,0]=2 38 B26R3.39898487 CCN(CC(O)COc1cccc2c1c3c([nH]2)cccc3)C(C)C 2230a_200000032585_100000210202 [0,2,0,0,0,0|0,0,0]=2 39 B26R3.39898487 CCN(CC(O)COc1cccc2c1c3c([nH]2)cccc3)C(C)C 269982a_200000032585_100000204670 [0,2,0,0,0,0|0,0,0]=2 40 B24R3.2432599 Cc1ccccc1c2ccccc2OC[C@H]3COC(O3)(C)C 7a_200011997984_100015422573 [0,0,1,1,0,0|2,0,0]=4 41 B24R3.12010882 CC1(OCC(O1)CSc2cccc(c2)Nc3ccccc3)C 62a_100000198056_100000701362 [0,0,1,1,0,0|1,1,0]=4 42 B24R3.12010882 CC1(OC[C@@H](O1)COc2cccc(c2)Cc3ccccc3)C 7a_100000073777_100015422573 [0,0,1,1,0,0|2,0,0]=4 43 B24R3.12010882 CC1(OC[C@@H](O1)COc2cccc(c2)Nc3ccccc3)C 7a_100000031534_100015422573 [0,0,1,1,0,0|1,0,0]=3 44 B24R3.12010882 CC1(OC[C@@H](O1)COc2cccc(c2)Oc3ccccc3)C 7a_100000199087_100015422573 [0,0,1,1,0,0|2,0,0]=4 45 B24R3.12010882 CC1(OC[C@@H](O1)CSc2cccc(c2)Nc3ccccc3)C 62a_100015422573_100000701362 [0,0,1,1,0,0|1,1,0]=4 46 B24R4.40862 OC1CCCCC1Oc2cccc3c2c4c(o3)cccc4 34a_100010256132_100000038908 [1,0,0,1,0,0|2,0,0]=4 47 B24R4.1584903 c1ccc2c(c1)oc3c2c(ccc3)OCC4CCCCO4 34a_100010256132_100000211543 [1,0,0,1,0,0|2,0,0]=4 48 B24R4.1584903 c1ccc2c(c1)oc3c2c(ccc3)OCC4CCCCO4 7a_100010256132_100000211543 [1,0,0,1,0,0|2,0,0]=4 49 B26R4.88455993 CC1(OC[C@@H](O1)COc2cccc3c2c4c(cc3)cccc4)C 7a_200000075460_100015422573 [0,0,0,1,0,1|2,0,0]=4 50 B26R4.3995190 CC(C)N1CCC(C1)COc2cccc3c2c4c(o3)cccc4 34a_100010256132_100015187125 [0,0,0,1,0,1|2,0,0]=4 51 B22R2.15289 CC(C)CCC(C)Oc1cccc(c1)Nc2ccccc2 34a_100000031534_100011261404 [0,0,1,0,1,0|2,0,0]=4 52 B22R2.27037 CC(C)NC(=O)COc1cccc(c1)Nc2ccccc2 34a_100000031534_100000183996 [0,0,1,0,1,0|0,0,2]=4 53 B22R2.27037 CC(C)NC(=O)COc1cccc(c1)Nc2ccccc2 7a_100000031534_100000183996 [0,0,1,0,1,0|0,0,2]=4 54 B22R2.27037 CC(COc1cccc(c1)Nc2ccccc2)CN(C)C 7a_100000031534_100015348159 [0,0,1,0,1,0|2,0,0]=4 55 B22R3.12318064 CC(C)CCCNc1cccc2c1c3c(o2)cccc3 34a_100009830322_100011214892 [1,0,0,0,1,0|2,0,0]=4 56 B22R3.12318064 CC(C)CCCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_100011214892 [1,0,0,0,1,0|1,0,0]=3 57 B22R3.12318064 CC(C)CCCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100011214892 [1,0,0,0,1,0|1,0,0]=3 58 B22R3.12318064 CC(C)CCCSc1cccc2c1c3c([nH]2)ccnc3 62a_100011214892_200037665351 [1,0,0,0,1,0|1,1,0]=4 59 B22R3.12318064 CC(C)OCCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000211751 [1,0,0,0,1,0|2,0,0]=4 60 B22R3.12318064 CC(C)OCCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000211751 [1,0,0,0,1,0|2,0,0]=4 61 B22R3.12318064 CC(C)SCCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000730970 [1,0,0,0,1,0|2,0,0]=4 62 B22R3.12318064 CC(C)SCCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000730970 [1,0,0,0,1,0|2,0,0]=4 63 B22R3.12318064 CC(O)CCCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_200000718107 [1,0,0,0,1,0|2,0,0]=4 64 B22R3.12318064 CC(O)CCCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_200000718107 [1,0,0,0,1,0|2,0,0]=4 65 B22R3.12318064 CN(C)CCCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000757444 [1,0,0,0,1,0|2,0,0]=4 66 B22R3.41066157 CC(C)CC(C)Oc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000731052 [0,0,0,0,2,0|2,0,0]=4 67 B22R3.41066157 CC(C)CC(C)Oc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000731052 [0,0,0,0,2,0|2,0,0]=4 68 B24R3.28614997 CC(C)CCCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011216152 [1,0,0,0,0,1|1,0,1]=4