natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD109317 | 2.3 | 604.61 | C29H36O12N2 | COc1cc(N(C(C)=O)[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)c(OC)c2c(C)cc(C)nc12 |
|
GD109328 | 2.08 | 550.69 | C30H46O9 | CO[C@H]1[C@@H](O)[C@@H](C)O[C@@H](O[C@@H]2CC[C@]3(C)[C@H]4CC[C@]5(C)[C@H](C6=CC(=O)OC6)[C@@H](O)C[C@@]5(O)[C@@H]4CC[C@@H]3C2)[C@@H]1O |
|
GD109329 | 2.08 | 550.69 | C30H46O9 | CO[C@H]1[C@@H](O)[C@@H](C)O[C@@H](O[C@@H]2CC[C@]3(C)[C@H]4CC[C@]5(C)[C@H](C6=CC(=O)OC6)[C@H](O)C[C@@]5(O)[C@@H]4CC[C@@H]3C2)[C@@H]1O |
|
GD109330 | 2.08 | 550.69 | C30H46O9 | CO[C@H]1[C@@H](O)[C@@H](C)O[C@@H](O[C@@H]2CC[C@]3(C)[C@H]4CC[C@]5(C)[C@H](C6=CC(=O)OC6)[C@@H](O)C[C@]5(O)[C@@H]4CC[C@@H]3C2)[C@@H]1O |
|
GD109332 | 2.04 | 579.58 | C26H29O12NS | CC(=O)OC[C@H]1O[C@H](Oc2ccc(C(=O)Cc3csc(C)n3)c(O)c2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD109333 | 2.04 | 579.58 | C26H29O12NS | CC(=O)OC[C@H]1O[C@@H](Oc2ccc(C(=O)Cc3csc(C)n3)c(O)c2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD109334 | 2.04 | 579.58 | C26H29O12NS | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(C(=O)Cc3csc(C)n3)c(O)c2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD109335 | 2.04 | 579.58 | C26H29O12NS | CC(=O)OC[C@@H]1O[C@H](Oc2ccc(C(=O)Cc3csc(C)n3)c(O)c2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD109336 | 2.16 | 521.48 | C26H23O9N3 | CC(=O)OC[C@@H]1O[C@H](n2nc(N3C(=O)c4ccccc4C3=O)c3ccccc32)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD109337 | 2.16 | 521.48 | C26H23O9N3 | CC(=O)OC[C@@H]1O[C@H](n2nc(N3C(=O)c4ccccc4C3=O)c3ccccc32)[C@@H](OC(C)=O)[C@H]1OC(C)=O |