Glycoside
GD058773
Name:
NoneFormula:
C16H20O6NClSmiles:
O=C[C@H](N[C@H]1COc2ccc(Cl)cc2C1)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
NC1COc2ccc(Cl)cc2C1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.12 | Num_rotatable_bonds: | 7 |
| MolWt: | 345.78 | Num_heavy_atoms: | 23 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD29338
Formula: C10H10ONCl
Smiles:
NC1COc2ccc(Cl)cc2C1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 0 |
| MolWt: | 183.64 | Num_heavy_atoms: | 12 |
| TPSA: | 35.25 | NumAromaticRings: | 1 |
