active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD029121 | 0.26 | 631.77 | C32H49O8N5 | Cc1cc(CCCC(=O)NC(C)(C)C(=O)N2CCNCC2)ccc1Cc1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)n[nH]c1C(C)C |
|
GD002386 | -2.04 | 666.43 | C21H27O13N7FP2 | NC(=O)c1ccc[n+]([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@@H]3O[C@H](n4cnc5c(N)ncnc54)[C@H](F)[C@H]3O)[C@H](O)[C@H]2O)c1 |
|
GD004433 | 3.37 | 967.2 | C51H82O17 | CCCCCC(=O)O[C@@H]1[C@H](C)O[C@H](O[C@H]2[C@H](CO)O[C@@H](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)[C@@H](O[C@@H]3O[C@H](C)[C@H](O)[C@H](O)[C@H]3O)[C@H]2O)[C@H](O)[C@H]1O |
|
GD001471 | 2.42 | 722.91 | C39H62O12 | C[C@@H]1O[C@H](OC[C@H](C)CCC(=O)[C@H](C)[C@@H]2C(=O)C[C@@H]3[C@@H]4CC=C5C[C@H](O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)CC[C@@]5(C)[C@H]4CC[C@@]23C)[C@H](O)[C@H](O)[C@H]1O |
|
GD027433 | 0.63 | 552.61 | C24H32O9N4S | CC(=O)OC[C@@H]1O[C@H](NC(=S)NN=Cc2ccc(N(C)C)cc2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD023900 | 0.67 | 569.59 | C24H31O11N3S | CCOc1cc(C=NNC(=S)N[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)ccc1O |
|
GD023081 | 0.28 | 555.56 | C23H29O11N3S | COc1cc(C=NNC(=S)N[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)ccc1O |
|
GD016186 | 0.28 | 555.56 | C23H29O11N3S | COc1ccc(C=NNC(=S)N[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)cc1O |
|
GD025758 | 0.58 | 539.56 | C23H29O10N3S | COc1cccc(C=NNC(=S)N[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)c1 |
|
GD001434 | -0.92 | 444.45 | C19H24O5N8 | NC(=O)c1cnn(-c2nc(NC3CCCC3)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1 |