active glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD000905 | 0.92 | 376.41 | C19H24O6N2 | CCCCCCC#Cc1cc2cn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c(=O)nc2o1 |
|
GD017925 | 3.01 | 828.01 | C42H69O15N | COC1C(OC(C)=O)CC(=O)OC(C)CC=CC=CC(O)C(C)CC(CC=O)C1OC1OC(C)C(OC2CC(C)(O)C(OC(=O)CC(C)C)C(C)O2)C(N(C)C)C1O |
|
GD000217 | 5.15 | 438.31 | C22H21O4N3Cl2 | COC1OC(COCc2ccc(Cl)cc2)C(OCc2ccc(Cl)cc2)C1N=[N+]=[N-] |
|
GD003825 | 4.69 | 612.66 | C29H32O9N4S | CC(=O)OCC1OC(n2c(C)c(N=Nc3ccc(C)cc3)c(C)c(C#N)c2=S)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
|
GD012491 | -1.98 | 1049.21 | C51H84O22 | CC1OC(OC2C(CO)OC(O[C@@H]3CC[C@]4(C)C(=CC[C@@H]5[C@@H]6C[C@@H]7O[C@](O)(CC[C@H](C)COC8OC(CO)C(O)C(O)C8O)[C@H](C)[C@H]7[C@@]6(C)CC[C@H]54)C3)C(OC3OC(C)C(O)C(O)C3O)C2O)C(O)C(O)C1O |
|
GD000416 | 3.43 | 652.68 | C32H32O11N2S | CC(=O)OCC1OC(N2C(S)=C(C#N)C(c3ccco3)C(C(C)=O)=C2c2ccccc2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O |
|
GD003004 | 1.49 | 844.9 | C43H56O17 | CC1OC(OC23C(=O)CC(C)(O)CC2(O)C=CC2=C3C(=O)c3ccc(C4CC(OC5CCC(OC6CC(O)C(O)C(C)O6)C(C)O5)C(O)C(C)O4)c(O)c3C2=O)CCC1O |
|
GD008388 | -2.4 | 1205.35 | C58H92O26 | CC=C(C)C(=O)OC1CC(C)(C)C[C@@H]2C3=CC[C@@H]4[C@](C)(CC[C@@H]5[C@](C)(CO)C(O[C@@H]6O[C@H](C(=O)O)[C@H](O)C(O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O[C@@H]7OC(CO)C(O)[C@H](O)[C@H]7O)C6O[C@@H]6OC(CO)C(O)C(O)C6O)CC[C@]45C)[C@@]3(C)CC(O)[C@]12CO |
|
GD007532 | -3.85 | 447.53 | C19H37O7N5 | CNC1C(O)C(OC2C(N)CC(N)C(OC3OC(CN)=CCC3N)C2O)OCC1(C)O |
|
GD021658 | 0.51 | 300.36 | C11H12O4N2S2 | OCC1OC(c2scc3c(=S)[nH]cnc23)C(O)C1O |