Glycoside
GD073368
Name:
NoneFormula:
C17H19O7N3Smiles:
COc1ccc(-c2ccccn2)nc1NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
COc1ccc(-c2ccccn2)nc1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | -1.27 | Num_rotatable_bonds: | 8 |
| MolWt: | 377.35 | Num_heavy_atoms: | 27 |
| TPSA: | 162.1 | NumAromaticRings: | 2 |
Unique Aglycone
AD34029
Formula: C11H11ON3
Smiles:
COc1ccc(-c2ccccn2)nc1N| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 1.73 | Num_rotatable_bonds: | 2 |
| MolWt: | 201.23 | Num_heavy_atoms: | 15 |
| TPSA: | 61.03 | NumAromaticRings: | 2 |
