Glycoside
GD009942
Name:
NoneFormula:
C16H17O5N5Smiles:
OC[C@@H]1O[C@H](n2cnc3c(COc4ccccn4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(COc3ccccn3)ncnc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 5 |
| MolWt: | 359.34 | Num_heavy_atoms: | 26 |
| TPSA: | 135.64 | NumAromaticRings: | 3 |
Unique Aglycone
AD07741
Formula: C11H8ON5
Smiles:
C1=Nc2c(COc3ccccn3)ncnc2[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.09 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 3 |
| MolWt: | 226.22 | Num_heavy_atoms: | 17 |
| TPSA: | 74.36 | NumAromaticRings: | 2 |
