active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD008382 | -0.85 | 311.33 | C15H21O6N | CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OCc1ccccc1 |
|
GD012519 | 2.63 | 876.14 | C44H81O14N3 | CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@H](OC(=O)CN(CC)CC)[C@H](C)O2)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(OC)C[C@H](C)C(=O)N[C@H](C)[C@H](O)[C@]1(C)O |
|
GD007806 | 4.14 | 918.26 | C48H91O13N3 | CCCCCCCC(=O)NCCCN(C)[C@@H]1C[C@H](C)O[C@H](O[C@@H]2[C@H](C)[C@H](O[C@@H]3C[C@@](C)(OC)[C@H](O)[C@H](C)O3)[C@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@H](C)N(C)C[C@H](C)C[C@]2(C)O)[C@H]1O |
|
GD016651 | 4.14 | 918.26 | C48H91O13N3 | CCCCCCCC(=O)NCCCN1C[C@H](C)C[C@@](C)(O)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@H](O)[C@H](C)O2)[C@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@H]1C |
|
GD014848 | -0.02 | 481.92 | C19H20O5N7ClS | CCNC(=O)[C@@H]1O[C@H](n2cnc3c(NNC(=O)Cc4cccs4)nc(Cl)nc32)[C@H](O)[C@H]1O |
|
GD000020 | -1.17 | 564.63 | C24H38O12NS | CCCCC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](COCC(CO)(CO)COS(=O)(=O)[O-])O[C@H]1OCCc1ccccc1 |
|
GD022160 | 2.26 | 598.63 | C28H30O9N4S | CC(=O)OCC1OC(NC(=S)NNc2c3ccccc3nc3ccccc23)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
|
GD006888 | 2.62 | 445.56 | C25H35O6N | CO[C@H](C(=O)NCCC(c1ccccc1)c1ccco1)[C@H](O)[C@H](O)[C@H](O)C=CC(C)(C)C |
|
GD002647 | 0.45 | 426.55 | C22H38O6N2 | CO[C@H](C(=O)NCC1CCCN(C(=O)C2CC2)C1)[C@H](O)[C@H](O)[C@H](O)C=CC(C)(C)C |
|
GD022391 | -1.98 | 458.45 | C16H22O8N6S | CC(C)(C)C(=O)C(=O)NS(=O)(=O)OC[C@@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@H]1O |