Glycoside
GD066138
Name:
NoneFormula:
C15H17O7N3Smiles:
O=C(NCc1ccc(-c2ncon2)cc1)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
NCc1ccc(-c2ncon2)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -2.0 | Num_rotatable_bonds: | 8 |
| MolWt: | 351.32 | Num_heavy_atoms: | 25 |
| TPSA: | 166.01 | NumAromaticRings: | 2 |
Unique Aglycone
AD31743
Formula: C9H9ON3
Smiles:
NCc1ccc(-c2ncon2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 175.19 | Num_heavy_atoms: | 13 |
| TPSA: | 64.94 | NumAromaticRings: | 2 |
