active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD001014 | 3.53 | 829.13 | C44H80O12N2 | CC[C@@H]1OC(=O)[C@H](C)[C@H](OC2CC(C)(OC)C(O)C(C)O2)[C@H](C)[C@H](OC2OC(C)CC(N(C)C)C2O)[C@@](C)(O)C[C@H](C)[C@H](NCC2CC=CCC2)[C@H](C)[C@H](O)[C@]1(C)O |
|
GD009138 | 0.93 | 650.72 | C32H44O8N4F2 | CNC(=O)[C@@H](NC(=O)[C@@H](OCc1ccc(F)cc1)[C@@H](O)[C@@H](O)[C@@H](OCc1ccc(F)cc1)C(=O)N[C@@H](C(=O)NC)C(C)C)C(C)C |
|
GD016278 | -3.74 | 512.47 | C21H28O11N4 | CO[C@H]1[C@H](O)[C@@H](n2ccc(=O)[nH]c2=O)O[C@H]1[C@H](O[C@@H]1OC(C(=O)N2CCCC2)=C[C@H](O)[C@H]1O)C(N)=O |
|
GD003538 | 4.28 | 571.62 | C30H37O10N | CCCCCc1cc(O[C@@H]2OC(C)(C)[C@H](OC)[C@H](OC(=O)c3ccc(C)[nH]3)[C@H]2O)c(C)c2oc(=O)c(C(=O)O)cc12 |
|
GD028779 | 2.19 | 516.55 | C26H32O9N2 | CO[C@@H]1[C@H](OC(=O)c2ccc(C)[nH]2)[C@H](O)[C@H](Oc2ccc3c(OCCN)cc(=O)oc3c2C)OC1(C)C |
|
GD005166 | -1.68 | 729.83 | C35H51O10N7 | CCn1c2ccccc2c2cc(NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C(O)C(O)C(O)C(O)CO)ccc21 |
|
GD006652 | 0.88 | 750.55 | C32H36O13N3Br | COC(=O)[C@@]1(C)Nc2c(O[C@@H]3OC(CO)[C@H](O)C(O)[C@H]3O)cc3c(c2C1=O)C[C@H](Br)CN3C(=O)c1cc2cc(OC)c(OC)c(OC)c2[nH]1 |
|
GD002978 | -2.85 | 268.22 | C11H12O6N2 | C#C[C@@]1(O)[C@H](CO)O[C@H](n2ccc(=O)[nH]c2=O)[C@H]1O |
|
GD017873 | 1.35 | 422.24 | C16H16O4N5Br | Nc1nc(OCc2ccc(Br)cc2)c2ncn(C3CC(O)C(O)O3)c2n1 |
|
GD012921 | 3.1 | 537.57 | C28H31O8N3 | CO[C@@H]1[C@H](OC(=O)c2ccc(C)[nH]2)[C@H](O)[C@H](Oc2ccc3c(Cn4ccnc4)cc(=O)oc3c2C)OC1(C)C |