synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD110819 | 3.04 | 637.43 | C28H29O12Br | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(C(=O)Cc3ccc(Br)cc3)c(O)c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110818 | 3.08 | 640.59 | C32H32O14 | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc3c(=O)c(-c4ccc5c(c4)OCCCO5)coc3c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD110007 | 2.82 | 642.62 | C33H30O10N4 | CCOC(=O)CNc1cnn([C@@H]2O[C@H](COC(=O)c3ccccc3)[C@H](OC(=O)c3ccccc3)[C@@H]2OC(=O)c2ccccc2)c(=O)n1 |
|
GD111203 | 3.38 | 646.65 | C33H34O10N4 | C[C@@]1(OC(=O)c2cccnc2)[C@](C)(OCOc2cccnc2)[C@@](O)(COCOc2cccnc2)O[C@]1(C)COC(=O)c1cccnc1 |
|
GD111205 | 3.38 | 646.65 | C33H34O10N4 | C[C@@]1(OCOc2cccnc2)[C@@](O)(COCOc2cccnc2)O[C@](C)(COC(=O)c2cccnc2)[C@@]1(C)OC(=O)c1cccnc1 |
|
GD111204 | 3.38 | 646.65 | C33H34O10N4 | C[C@]1(OC(=O)c2cccnc2)[C@@](C)(COC(=O)c2cccnc2)O[C@](O)(COCOc2cccnc2)[C@]1(C)OCOc1cccnc1 |
|
GD111206 | 3.38 | 646.65 | C33H34O10N4 | C[C@]1(COC(=O)c2cccnc2)O[C@](O)(COCOc2cccnc2)[C@](C)(OCOc2cccnc2)[C@]1(C)OC(=O)c1cccnc1 |
|
GD110820 | 3.36 | 655.71 | C35H37O8N5 | COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]c(NC(=O)C(C)C)nc43)[C@H](O)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD110008 | 2.6 | 661.64 | C30H31O14NS | CCOC(=O)c1oc2cc(OC[C@@H]3O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(C)=O)ccc2c(=O)c1-c1cscn1 |
|
GD113158 | 7.9 | 630.78 | C41H42O6 | c1ccc(COC[C@@H](OCc2ccccc2)[C@@H]2O[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)cc1 |