Glycoside
GD066500
Name:
NoneFormula:
C14H15O6N4ClSmiles:
Cn1nc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)c2ccc(Cl)nc21Aglycone:
Cn1nc(N)c2ccc(Cl)nc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -1.8 | Num_rotatable_bonds: | 6 |
| MolWt: | 358.74 | Num_heavy_atoms: | 24 |
| TPSA: | 157.8 | NumAromaticRings: | 2 |
Unique Aglycone
AD31829
Formula: C8H7N4Cl
Smiles:
Cn1nc(N)c2ccc(Cl)nc21| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 0 |
| MolWt: | 182.61 | Num_heavy_atoms: | 12 |
| TPSA: | 56.73 | NumAromaticRings: | 2 |
