Glycoside
GD096081
Name:
NoneFormula:
C19H23O10NS2Smiles:
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cc1Aglycone:
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 7 |
| MolWt: | 489.52 | Num_heavy_atoms: | 32 |
| TPSA: | 179.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD40862
Formula: C13H13O5NS2
Smiles:
CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 327.38 | Num_heavy_atoms: | 21 |
| TPSA: | 100.54 | NumAromaticRings: | 2 |
