Glycoside
GD011055
Name:
NoneFormula:
C26H28O7N6Smiles:
COC(=O)COc1cc(CNc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)ccc1-c1ccccc1Aglycone:
COC(=O)COc1cc(CNC2=Nc3c(N)ncnc3[N]2)ccc1-c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.31 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 9 |
| MolWt: | 536.55 | Num_heavy_atoms: | 39 |
| TPSA: | 187.1 | NumAromaticRings: | 4 |
Unique Aglycone
AD08476
Formula: C21H19O3N6
Smiles:
COC(=O)COc1cc(CNC2=Nc3c(N)ncnc3[N]2)ccc1-c1ccccc1| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 403.42 | Num_heavy_atoms: | 30 |
| TPSA: | 125.82 | NumAromaticRings: | 3 |
