Glycoside
GD100210
Name:
NoneFormula:
C20H22O8NClSSmiles:
Cc1cccc(Cl)c1S(=O)(=O)Nc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
Cc1cccc(Cl)c1S(=O)(=O)Nc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 459.9 | Num_heavy_atoms: | 30 |
| TPSA: | 145.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD42348
Formula: C14H12O3NClS
Smiles:
Cc1cccc(Cl)c1S(=O)(=O)Nc1ccc(O)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 3.15 | Num_rotatable_bonds: | 3 |
| MolWt: | 297.76 | Num_heavy_atoms: | 19 |
| TPSA: | 66.4 | NumAromaticRings: | 2 |
