Glycoside
GD091046
Name:
NoneFormula:
C20H24O6N6Smiles:
CNC(=O)CCOc1ccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
CNC(=O)CCOc1ccc(Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 8 |
| MolWt: | 444.45 | Num_heavy_atoms: | 32 |
| TPSA: | 163.88 | NumAromaticRings: | 3 |
Unique Aglycone
AD39670
Formula: C15H15O2N6
Smiles:
CNC(=O)CCOc1ccc(Nc2ncnc3c2N=C[N]3)cc1| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 6 |
| MolWt: | 311.33 | Num_heavy_atoms: | 23 |
| TPSA: | 102.6 | NumAromaticRings: | 2 |
