Glycoside
GD085214
Name:
NoneFormula:
C20H20O5N6Smiles:
C#Cc1ccccc1C(=O)n1c(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3OC)c2nc1=NAglycone:
C#Cc1ccccc1C(=O)n1c(N)c2c(nc1=N)[N]C=N2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | -0.77 | Num_rotatable_bonds: | 4 |
| MolWt: | 424.42 | Num_heavy_atoms: | 31 |
| TPSA: | 161.5 | NumAromaticRings: | 3 |
Unique Aglycone
AD38123
Formula: C14H9ON6
Smiles:
C#Cc1ccccc1C(=O)n1c(N)c2c(nc1=N)[N]C=N2| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 1 |
| MolWt: | 277.27 | Num_heavy_atoms: | 21 |
| TPSA: | 111.22 | NumAromaticRings: | 2 |
