Glycoside
GD044407
Name:
NoneFormula:
C13H17O5N3Smiles:
OC[C@H]1O[C@H](O)[C@H](Nc2cccn3cncc23)[C@@H](O)[C@@H]1OAglycone:
Nc1cccn2cncc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -1.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 295.3 | Num_heavy_atoms: | 21 |
| TPSA: | 119.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD25010
Formula: C7H7N3
Smiles:
Nc1cccn2cncc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 0 |
| MolWt: | 133.15 | Num_heavy_atoms: | 10 |
| TPSA: | 43.32 | NumAromaticRings: | 2 |
