Glycoside
GD084589
Name:
NoneFormula:
C17H18O7NClSSmiles:
O=S(=O)(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cccc2c(Cl)cccc12Aglycone:
NS(=O)(=O)c1cccc2c(Cl)cccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 403.84 | Num_heavy_atoms: | 26 |
| TPSA: | 136.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD37801
Formula: C11H8O2NClS
Smiles:
NS(=O)(=O)c1cccc2c(Cl)cccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.14 | Num_rotatable_bonds: | 1 |
| MolWt: | 241.7 | Num_heavy_atoms: | 15 |
| TPSA: | 60.16 | NumAromaticRings: | 2 |
