synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD112065 | 3.85 | 607.5 | C31H31O6N2Br | Cc1ccc(C(OC[C@@H]2O[C@@H](n3cc(Br)c(=O)[nH]c3=O)[C@@H](O)[C@H]2O)(c2ccc(C)cc2)c2ccc(C)cc2)cc1 |
|
GD112064 | 3.85 | 607.5 | C31H31O6N2Br | Cc1ccc(C(OC[C@H]2O[C@@H](n3cc(Br)c(=O)[nH]c3=O)[C@@H](O)[C@@H]2O)(c2ccc(C)cc2)c2ccc(C)cc2)cc1 |
|
GD112066 | 3.85 | 607.5 | C31H31O6N2Br | Cc1ccc(C(OC[C@@H]2O[C@@H](n3cc(Br)c(=O)[nH]c3=O)[C@@H](O)[C@@H]2O)(c2ccc(C)cc2)c2ccc(C)cc2)cc1 |
|
GD108030 | 1.74 | 565.55 | C25H27O12NS | CC(=O)OC[C@@H]1O[C@H](Oc2ccc(C(=O)Cc3cscn3)c(O)c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD106560 | -0.47 | 526.51 | C24H26O8N6 | O=C(CCCCCN1C(=O)c2ccccc2C1=O)Nc1nc2c(ncn2[C@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1 |
|
GD106559 | -0.47 | 526.51 | C24H26O8N6 | O=C(CCCCCN1C(=O)c2ccccc2C1=O)Nc1nc2c(ncn2[C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1 |
|
GD109157 | 2.38 | 575.55 | C26H25O12NS | CC(=O)OC[C@H]1O[C@@H](Oc2ccc3c(=O)c(-c4cscn4)coc3c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD104878 | 2.02 | 459.54 | C22H37O9N | CCCCCCCCO[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1NC(C)=O |
|
GD108578 | 1.97 | 551.6 | C24H25O10NS2 | CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C/c3ccccc3)SC2=S)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD109016 | 2.07 | 614.51 | C29H26O15 | CC(=O)Oc1c(O[C@H]2O[C@@H](C(=O)O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)cc2oc(-c3ccccc3)cc(=O)c2c1O |