synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD108579 | 1.7 | 595.6 | C25H25O12NS2 | CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD109864 | 2.83 | 609.58 | C31H31O12N | CC(=O)OC[C@H]1O[C@@H](Oc2ccc(C(=O)Cc3ccc4ncccc4c3)c(O)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110685 | 3.42 | 715.75 | C36H45O14N | COc1ccc(C2(CNC(=O)c3ccc(O[C@@H]4O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]4OC(C)=O)c(OC)c3)CCCC2)cc1OC |
|
GD110683 | 3.42 | 715.75 | C36H45O14N | COc1ccc(C2(CNC(=O)c3ccc(O[C@@H]4O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]4OC(C)=O)c(OC)c3)CCCC2)cc1OC |
|
GD110686 | 3.42 | 715.75 | C36H45O14N | COc1ccc(C2(CNC(=O)c3ccc(O[C@@H]4O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]4OC(C)=O)c(OC)c3)CCCC2)cc1OC |
|
GD110684 | 3.42 | 715.75 | C36H45O14N | COc1ccc(C2(CNC(=O)c3ccc(O[C@@H]4O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]4OC(C)=O)c(OC)c3)CCCC2)cc1OC |
|
GD107819 | 1.5 | 592.34 | C21H25O10N2I | CC(=O)OC[C@@H]1O[C@@H](NC(=O)Nc2ccccc2I)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD113007 | 7.44 | 568.72 | C32H28O4N2S2 | Cc1ccc(O[C@H]2O[C@@H](SC3=N/C(=C\c4cccs4)C(=O)N3c3ccccc3)C[C@H]2Oc2ccc(C)cc2)cc1 |
|
GD113008 | 7.44 | 568.72 | C32H28O4N2S2 | Cc1ccc(O[C@H]2C[C@H](SC3=N/C(=C\c4cccs4)C(=O)N3c3ccccc3)O[C@@H]2Oc2ccc(C)cc2)cc1 |
|
GD113010 | 7.44 | 568.72 | C32H28O4N2S2 | Cc1ccc(O[C@H]2O[C@H](SC3=N/C(=C\c4cccs4)C(=O)N3c3ccccc3)C[C@H]2Oc2ccc(C)cc2)cc1 |