Glycoside
GD036419
Name:
NoneFormula:
C22H27O10NSSmiles:
COc1ccc(OS(C)(=O)=O)cc1-c1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=OAglycone:
COc1ccc(OS(C)(=O)=O)cc1-c1ccccc1OSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 8 |
| MolWt: | 497.52 | Num_heavy_atoms: | 34 |
| TPSA: | 160.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD22968
Formula: C14H14O5S
Smiles:
COc1ccc(OS(C)(=O)=O)cc1-c1ccccc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 2.41 | Num_rotatable_bonds: | 4 |
| MolWt: | 294.33 | Num_heavy_atoms: | 20 |
| TPSA: | 72.83 | NumAromaticRings: | 2 |
