synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD109935 | 2.93 | 592.98 | C29H29O12Cl | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(C(=O)Cc3ccc(Cl)cc3)c(O)c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD109928 | 2.93 | 592.98 | C29H29O12Cl | CC(=O)OC[C@@H]1O[C@H](Oc2ccc(C(=O)Cc3ccc(Cl)cc3)c(O)c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD085316 | 0.4 | 421.43 | C19H19O8NS | Cc1csc(-c2coc3cc(O[C@@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)ccc3c2=O)n1 |
|
GD110761 | 3.06 | 586.52 | C29H27O12F | CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(=O)c(-c4ccc(F)cc4)coc3c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD110760 | 3.06 | 586.52 | C29H27O12F | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc3c(=O)c(-c4ccc(F)cc4)coc3c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD111636 | 3.68 | 647.43 | C29H27O12Br | CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(=O)c(-c4ccc(Br)cc4)coc3c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD111637 | 3.68 | 647.43 | C29H27O12Br | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc3c(=O)c(-c4ccc(Br)cc4)coc3c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD109927 | 2.69 | 589.58 | C27H27O12NS | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc3c(=O)c(-c4nc(C)cs4)coc3c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD109936 | 2.69 | 589.58 | C27H27O12NS | CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(=O)c(-c4nc(C)cs4)coc3c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD109933 | 2.69 | 626.57 | C31H30O14 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(=O)c(-c4ccc5c(c4)OCCO5)coc3c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |