Glycoside
GD096113
Name:
NoneFormula:
C21H25O10NSSmiles:
CCOC(=O)c1ccc(S(=O)(=O)Nc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cc1Aglycone:
CCOC(=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: | 0.38 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 8 |
| MolWt: | 483.5 | Num_heavy_atoms: | 33 |
| TPSA: | 171.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD40877
Formula: C15H15O5NS
Smiles:
CCOC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.37 | Num_rotatable_bonds: | 5 |
| MolWt: | 321.35 | Num_heavy_atoms: | 22 |
| TPSA: | 92.7 | NumAromaticRings: | 2 |
