Glycoside
GD097843
Name:
NoneFormula:
C19H18O9NClSSmiles:
O=C(Nc1ccccc1S(=O)(=O)Oc1ccccc1Cl)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Nc1ccccc1S(=O)(=O)Oc1ccccc1ClSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.22 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 9 |
| MolWt: | 459.86 | Num_heavy_atoms: | 30 |
| TPSA: | 170.46 | NumAromaticRings: | 2 |
Unique Aglycone
AD41628
Formula: C13H10O3NClS
Smiles:
Nc1ccccc1S(=O)(=O)Oc1ccccc1Cl| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.69 | Num_rotatable_bonds: | 3 |
| MolWt: | 283.74 | Num_heavy_atoms: | 18 |
| TPSA: | 69.39 | NumAromaticRings: | 2 |
