Glycoside
GD070359
Name:
NoneFormula:
C17H18O6N4Smiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Nc1ccc2occc2c1Aglycone:
NC(=O)C1=C(Nc2ccc3occc3c2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.29 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 5 |
| MolWt: | 374.35 | Num_heavy_atoms: | 27 |
| TPSA: | 156.0 | NumAromaticRings: | 3 |
Unique Aglycone
AD33326
Formula: C12H9O2N4
Smiles:
NC(=O)C1=C(Nc2ccc3occc3c2)[N]C=N1| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.15 | Num_rotatable_bonds: | 3 |
| MolWt: | 241.23 | Num_heavy_atoms: | 18 |
| TPSA: | 94.72 | NumAromaticRings: | 2 |
