active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD000243 | -0.06 | 772.86 | C35H52O10N10 | CCOC(=O)NC(=O)c1cn(CCN2CCN(C(=O)CCCCCCCCCCNc3ncnc4c3ncn4C3OC(CO)C(O)C3O)CC2)c(=O)[nH]c1=O |
|
GD019166 | -3.05 | 190.16 | C5H10O4N4 | OCC(O)C(O)C(O)c1nnn[nH]1 |
|
GD014173 | 0.65 | 441.49 | C22H27O5N5 | C[C@@H]1O[C@H](n2cc(-c3ccccc3)c3c(NCC(=O)NCCCO)ncnc32)[C@H](O)[C@H]1O |
|
GD018656 | 2.97 | 795.02 | C43H70O13 | COC(=O)[C@@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@]4(C)CC[C@H](OC5OC(CO)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C)[C@H]4CC[C@@]3(C)[C@@]1(C)CC2 |
|
GD011169 | 6.97 | 707.86 | C43H49O8N | CC(C)(C)OC(=O)C1C(=O)NC(=O)CC1CC(OCc1ccccc1)C(OCc1ccccc1)C(COCc1ccccc1)OCc1ccccc1 |
|
GD021754 | 16.91 | 1447.84 | C73H133O17N6FP2 | CCCCCCCCCCCCCCCCCCNc1ccn(C2OC(CO)C(OP(=O)(O)OCC(COP(=O)(O)OCC3OC(n4cc(F)c(NCCCCCCCCCCCCCCCCCC)nc4=O)CC3O)OC(=O)CCCCCCCCCCCCCCC)C2O)c(=O)n1 |
|
GD019950 | -0.22 | 664.61 | C31H36O16 | COc1ccc(-c2cc(=O)c3c(O)c(OC)c(O[C@@H]4OC(CO[C@@H]5OC(C)[C@H](O)[C@H](O)C5OC(C)=O)[C@H](O)[C@H](O)C4O)cc3o2)cc1 |
|
GD006191 | -6.11 | 1243.35 | C57H94O29 | CC1CC[C@]2(OC1)OC1C[C@@H]3[C@@H]4CC[C@@H]5CC(OC6OC(CO)C(O)C(OC7OC(CO)C(OC8OC(CO)C(O)C(OC9OC(CO)C(O)C(O)C9O)C8OC8OC(CO)C(O)C(O)C8O)C(O)C7O)C6O)[C@H](O)CC5(C)[C@H]4CCC3(C)C1[C@H]2C |
|
GD017815 | 1.06 | 356.42 | C17H28O6N2 | CC1CC[C@H](C(C)C)[C@H](Oc2nnc(C3OC(CO)C(O)C3O)o2)C1 |
|
GD000393 | 1.96 | 494.52 | C22H26O9N2S | CC(=O)OCC1OC(n2c(C)cc(C)c(C#N)c2=S)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |