Glycoside
GD021390
Name:
NoneFormula:
C23H20O5N4Smiles:
Nc1ncnc2c1c1cc(-c3cc4ccccc4o3)ccc1n2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1-c1cc(-c3cc4ccccc4o3)ccc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.22 |
| AlogP: | 2.19 | Num_rotatable_bonds: | 3 |
| MolWt: | 432.44 | Num_heavy_atoms: | 32 |
| TPSA: | 139.79 | NumAromaticRings: | 5 |
Unique Aglycone
AD14636
Formula: C18H11ON4
Smiles:
Nc1ncnc2c1-c1cc(-c3cc4ccccc4o3)ccc1[N]2| HBA: | 5 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 4.02 | Num_rotatable_bonds: | 1 |
| MolWt: | 299.31 | Num_heavy_atoms: | 23 |
| TPSA: | 79.04 | NumAromaticRings: | 4 |
