Glycoside
GD108681
Name:
NoneFormula:
C25H27O6N7Smiles:
COc1cc(C/N=N/c2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)ccc1OCc1ccccc1Aglycone:
COc1cc(CN=NC2=Nc3c(N)ncnc3[N]2)ccc1OCc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 9 |
| MolWt: | 521.53 | Num_heavy_atoms: | 38 |
| TPSA: | 182.72 | NumAromaticRings: | 4 |
Unique Aglycone
AD44462
Formula: C20H18O2N7
Smiles:
COc1cc(CN=NC2=Nc3c(N)ncnc3[N]2)ccc1OCc1ccccc1| HBA: | 9 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 3.54 | Num_rotatable_bonds: | 6 |
| MolWt: | 388.41 | Num_heavy_atoms: | 29 |
| TPSA: | 121.44 | NumAromaticRings: | 3 |
