active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD016644 | 1.21 | 475.52 | C22H25O7N3S | CNc1nc2c(Cc3cccnc3)c(C)c(O[C@@H]3O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]3O)c(C)c2s1 |
|
GD012073 | -5.82 | 354.36 | C13H26O9N2 | NC[C@@H]1O[C@H](CO)[C@H](N[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O |
|
GD027114 | 4.12 | 604.82 | C32H60O10 | CCCCCCCCC=CCCCCCCCC(=O)OCCOCC(OCCO)C1OCC(OCCO)C1OCCO |
|
GD026261 | 1.8 | 464.56 | C25H36O8 | C[C@@]12CCC(=O)C=C1CC[C@H]1[C@H]2CC[C@@]2(C)[C@H](O[C@@H]3O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]3O)CC[C@H]12 |
|
GD016207 | 0.11 | 320.3 | C16H16O7 | O=C(O)[C@@H]1O[C@H](Oc2cccc3ccccc23)[C@H](O)[C@H](O)[C@H]1O |
|
GD009793 | -0.37 | 535.53 | C25H30O9N3F | Cc1c(F)c(N2CCNC(C)C2)cc2c1c(=O)c(C(=O)O[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)cn2C1CC1 |
|
GD019682 | 1.88 | 760.8 | C39H44O12N4 | C=CC1=C(C)C(=Cc2[nH]c(Cc3[nH]c(C=C4NC(=O)C(C)=C4C=C)c(C)c3CCC(=O)O[C@@H]3OC(C(=O)O)[C@H](O)C(O)C3O)c(CCC(=O)O)c2C)NC1=O |
|
GD021111 | 2.79 | 822.99 | C43H66O15 | CC(=O)O[C@@H]1C[C@H](O[C@H]2[C@H](C)O[C@@H](O[C@H]3[C@H](C)O[C@@H](O[C@@H]4CC[C@@]5(C)[C@@H](CC[C@H]6[C@H]5C[C@H](O)[C@]5(C)[C@H](C7=CC(=O)OC7)CC[C@@]65O)C4)C[C@H]3O)C[C@H]2O)O[C@H](C)[C@H]1O |
|
GD019537 | 2.84 | 501.57 | C24H39O10N | CCCCCC=CCC(=CCCCCCCCC(=O)O[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)[N+](=O)[O-] |
|
GD031215 | -1.1 | 764.69 | C35H40O19 | COc1cc([C@@H]2c3cc4c(cc3[C@H](O[C@@H]3O[C@@H]5CO[C@H](C)O[C@H]5[C@H](O)[C@H]3O)[C@@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1O[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O |