Glycoside
GD055511
Name:
NoneFormula:
C15H18O7N2Smiles:
Cc1noc2ccc(CNC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)cc12Aglycone:
Cc1noc2ccc(CN)cc12Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 338.32 | Num_heavy_atoms: | 24 |
| TPSA: | 153.12 | NumAromaticRings: | 2 |
Unique Aglycone
AD28067
Formula: C9H10ON2
Smiles:
Cc1noc2ccc(CN)cc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 1 |
| MolWt: | 162.19 | Num_heavy_atoms: | 12 |
| TPSA: | 52.05 | NumAromaticRings: | 2 |
