Glycoside
GD057210
Name:
NoneFormula:
C15H17O5N5Smiles:
O[C@@H]1[C@@H](O)[C@H](O)O[C@H](Cn2cc(-c3cnc4ccccn34)nn2)[C@@H]1OAglycone:
Cn1cc(-c2cnc3ccccn23)nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 3 |
| MolWt: | 347.33 | Num_heavy_atoms: | 25 |
| TPSA: | 138.16 | NumAromaticRings: | 3 |
Unique Aglycone
AD28722
Formula: C10H9N5
Smiles:
Cn1cc(-c2cnc3ccccn23)nn1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.1 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 199.22 | Num_heavy_atoms: | 15 |
| TPSA: | 48.01 | NumAromaticRings: | 3 |
