active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD034275 | 3.2 | 806.94 | C42H62O15 | COC1C(O)C(C)OC(O[C@@H]2C(OC)COC(O[C@@H]3C[C@@H]4CC(=O)[C@]5(O)O[C@H](C[C@H]5C)C(C)(C)[C@H](C=Cc5ccccc5)OC(=O)C[C@H](O4)[C@H]3C)[C@H]2OC)[C@H]1OC |
|
GD005065 | 3.81 | 592.6 | C31H32O10N2 | CO[C@@H]1[C@H](OC(=O)c2ccc(C)[nH]2)[C@H](O)[C@H](Oc2ccc3c(O)c(C(=O)Nc4ccccc4)c(=O)oc3c2C)OC1(C)C |
|
GD004333 | 4.13 | 842.76 | C43H38O18 | CO[C@@H]1O[C@H](COC(=O)C=Cc2ccc(O)c(O)c2)[C@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@H](OC(=O)C=Cc2ccc(O)c(O)c2)[C@H]1OC(=O)C=Cc1ccc(O)c(O)c1 |
|
GD027324 | 1.9 | 773.02 | C40H72O12N2 | C#C[C@@]1(O)[C@H](C)O[C@H](O[C@H]2[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@](C)(O)[C@@H](O[C@@H]3O[C@H](C)C[C@H](N(C)C)[C@H]3O)[C@H]2C)C[C@]1(C)OC |
|
GD007164 | -1.8 | 463.53 | C20H37O9N3 | CC1OC(OCCCCCCNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(O)C(O)C1O |
|
GD019738 | 2.03 | 430.53 | C21H26O4N4S | CC(C)(C)c1ccc(CSc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1 |
|
GD011501 | 4.06 | 443.58 | C26H37O5N | CO[C@@H]1O[C@H](COCCCCCN)C[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |
|
GD014498 | 1.38 | 408.87 | C18H17O4N4ClS | OC[C@@H]1O[C@H](n2cnc3c(SCc4ccccc4Cl)ncnc32)[C@H](O)[C@H]1O |
|
GD006288 | 0.88 | 844.92 | C43H52O12N6 | CC(=O)N[C@@H]1[C@H](OC(C)C(=O)N[C@H](C)C(=O)N[C@H](CCC(=O)OCCCNC(=O)c2cccc3cc4ccccc4nc23)C(N)=O)C(O)C(CO)O[C@H]1OCc1ccccc1 |
|
GD011748 | 2.5 | 775.03 | C40H74O12N2 | C=CC[C@]1(O)[C@H](C)O[C@H](O[C@H]2[C@H](C)C(=O)O[C@@H](CC)[C@](C)(O)[C@@H](O)[C@@H](C)NC[C@@H](C)C[C@](C)(O)[C@@H](O[C@@H]3O[C@H](C)C[C@H](N(C)C)[C@H]3O)[C@H]2C)C[C@]1(C)OC |