active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD008403 | -0.08 | 513.56 | C24H31O6N7 | CCNC(=O)[C@@H]1O[C@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)OC)cc4)nc32)[C@H](O)[C@H]1O |
|
GD027497 | -0.55 | 485.5 | C22H27O6N7 | CCNC(=O)[C@@H]1O[C@H](n2cnc3c(N)nc(NCCc4ccc(CC(=O)O)cc4)nc32)[C@H](O)[C@H]1O |
|
GD000308 | 2.19 | 703.75 | C36H41O10N5 | CC[C@@]12C=CCN3CC[C@@]4(C(=C(C(=O)OC)[C@H]1Nc1ccn(C5OC(COC(C)=O)C(OC(C)=O)C5OC(C)=O)c(=O)n1)Nc1ccccc14)C32 |
|
GD001065 | 2.86 | 827.88 | C42H53O16N | CC[C@]1(O)C[C@H](OC2CC(N(C)C)C(OC3CC(O)C(OC4CCC(=O)C(C)O4)C(C)O3)C(C)O2)c2c(O)c3c(c(O)c2C1C(=O)OC)C(=O)c1cccc(O)c1C3=O |
|
GD013695 | 3.38 | 750.97 | C41H66O12 | C=C(C)[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)[C@H](CCC4[C@]5(C)CC[C@H](OC6OC(CO)C(O)C6OC6OC(C)C(O)C(O)C6O)[C@](C)(CO)C5CC[C@]43C)C12 |
|
GD000215 | -1.73 | 1074.22 | C52H83O22N | CC1OC(OC2C(OC(=O)[C@@]34CCC(C)(C)CC3C3=CCC5[C@]6(C)C[C@H](O)[C@H](OC7OC(CO)C(O)C(O)C7N)[C@@](C)(C(=O)O)C6CC[C@@]5(C)[C@@]3(C)CC4)OCC(O)C2O)C(O)C(O)C1OC1OCC(O)C(O)C1O |
|
GD006272 | 0.96 | 390.78 | C18H15O5N4Cl | O=C(OC[C@@H]1O[C@H](n2cnc3c(Cl)ncnc32)[C@H](O)[C@H]1O)c1ccccc1 |
|
GD004765 | 1.93 | 840.88 | C42H52O16N2 | CC[C@]1(O)C[C@H](OC2CC(N(C)C)C(OC3CC(O)C(OC4OC(C)C(=O)C=C4N)C(C)O3)C(C)O2)c2c(O)c3c(c(O)c2C1C(=O)OC)C(=O)c1cccc(O)c1C3=O |
|
GD010543 | 1.38 | 595.37 | C26H24O10FBr | CC1OC(O[C@@H]2C[C@](O)(C(=O)CBr)Cc3c(O)c4c(c(O)c32)C(=O)c2ccccc2C4=O)C(F)C(O)C1O |
|
GD007966 | -1.78 | 388.37 | C17H24O10 | C=CC1C(CC=O)C(C(=O)OC)=CO[C@H]1OC1OC(CO)C(O)C(O)C1O |