aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20391 | 4.51 | 270.76 | C18H15OCl | C=Cc1ccc(Cc2ccc3c(c2Cl)CCO3)cc1 |
|
AD20392 | 0.71 | 151.12 | C6H4N4F | Nc1ncc(F)c2c1N=C[N]2 |
|
AD20393 | 4.52 | 1047.04 | C53H54O17N6 | COc1cc(C2c3cc4c(cc3C(n3cc(COCC(O)COCc5cn(C6c7cc8c(cc7C(c7cc(OC)c(OC)c(OC)c7)C7C(=O)OCC76)OCO8)nn5)nn3)C3COC(=O)C23)OCO4)cc(OC)c1OC |
|
AD20394 | 5.19 | 690.96 | C40H66O9 | CCC(C)C(=O)OC1C(O)C(C)(C)CC2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)C(OC(=O)CC(C)C)C(O)C21CO |
|
AD20395 | 0.25 | 198.22 | C10H14O4 | CC(C)=CC1OC(CO)C2C(=O)OC12 |
|
AD20396 | 1.29 | 309.38 | C12H23O6NS | COC(=O)CCCCCCCCC(=O)NS(=O)(=O)OC |
|
AD20397 | -0.81 | 177.97 | H4O7P2 | O=P(O)(O)OP(=O)(O)O |
|
AD20398 | 3.11 | 356.47 | C18H16O2N2S2 | CSCCNC(=S)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O |
|
AD20399 | 3.84 | 642.83 | C36H54O8N2 | CCC1OC(=O)CC(O)C(C)C(O)C(CC(C(=O)NC(C)(C)C)N(C)C(=O)c2ccccc2)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD20400 | 7.84 | 699.93 | C39H61O8N3 | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OC(=O)CCC(=O)OC6CCN([N+]([O-])=NO)CC6)C(C)(C)C5CCC43C)C2C1 |