Glycoside
GD064999
Name:
NoneFormula:
C14H20O7N4Smiles:
NC(=O)[C@@H]1CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)Cc2ccnn21Aglycone:
NC(=O)C1CCNCc2ccnn21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.57 |
| AlogP: | -3.71 | Num_rotatable_bonds: | 6 |
| MolWt: | 356.34 | Num_heavy_atoms: | 25 |
| TPSA: | 179.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD31263
Formula: C8H12ON4
Smiles:
NC(=O)C1CCNCc2ccnn21| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 1 |
| MolWt: | 180.21 | Num_heavy_atoms: | 13 |
| TPSA: | 72.94 | NumAromaticRings: | 1 |
