Glycoside
GD092386
Name:
NoneFormula:
C13H15O7NClSBrSmiles:
O=C[C@H](NS(=O)(=O)c1ccc(Br)cc1Cl)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
NS(=O)(=O)c1ccc(Br)cc1ClSugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 8 |
| MolWt: | 432.68 | Num_heavy_atoms: | 23 |
| TPSA: | 144.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD39639
Formula: C7H5O2NClSBr
Smiles:
NS(=O)(=O)c1ccc(Br)cc1Cl| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 1 |
| MolWt: | 270.53 | Num_heavy_atoms: | 12 |
| TPSA: | 60.16 | NumAromaticRings: | 1 |
