active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD021177 | 0.21 | 885.05 | C45H72O17 | CC1OC(OC2C(O[C@@H]3CC[C@]4(C)C(=CC[C@@H]5[C@@H]6C[C@@H]7O[C@]8(CC[C@H](C)CO8)[C@H](C)[C@H]7[C@@]6(C)CC[C@H]54)C3)OC(CO)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O |
|
GD004490 | 0.7 | 351.43 | C15H21O3N5S | Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSC2CCCC2)[C@H](O)[C@H]1O |
|
GD010292 | -0.74 | 903.07 | C45H74O18 | CC1OC(OC2C(O[C@@H]3C[C@@H]4CC[C@@H]5[C@H](CC[C@]6(C)[C@H]5C[C@@H]5O[C@]7(CC[C@H](C)CO7)[C@H](C)[C@H]56)[C@@]4(C)C[C@H]3O)OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C(O)C1O |
|
GD015355 | 0.05 | 534.47 | C25H26O13 | COc1cc2c(cc1OC)-c1c(oc3cc(OC4OC(CO)C(O)C(O)C4O)c(OC)cc3c1=O)C(O)O2 |
|
GD007034 | 4.65 | 575.68 | C27H50O8N3P | CCCCCCCCCCCCCCCCCCNc1ccn(C2OC(COP(=O)(O)O)C(O)C2O)c(=O)n1 |
|
GD007834 | 0.31 | 445.45 | C20H19O7N3S | COc1ccc(-c2c(C#N)c(O)n(C3OC(CO)C(O)C(O)C3O)c(=S)c2C#N)cc1 |
|
GD028198 | 1.13 | 373.44 | C17H19O3N5S | Cc1ccc(SC[C@@H]2O[C@H](n3cnc4c(N)ncnc43)[C@H](O)[C@H]2O)cc1 |
|
GD030846 | 0.21 | 360.4 | C15H16O3N6S | Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSc2ccncc2)[C@H](O)[C@H]1O |
|
GD000482 | 0.43 | 448.44 | C23H20O6N4 | O=c1[nH]c(=O)n(C2OC(CO)C(O)C2O)c2nc(-c3ccc(-c4ccccc4)cc3)cnc12 |
|
GD021579 | 11.15 | 800.12 | C43H82O8N3P | CCCCCCCCCCCCCCCCCCNc1ccn(C2OC(COP(=O)(O)OCCCCCCCCCCCCCCCC)C(O)C2O)c(=O)n1 |