Glycoside
GD101270
Name:
NoneFormula:
C21H27O8NSSmiles:
CC(C)S(=O)(=O)c1ccc(Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)cc1Aglycone:
CC(C)S(=O)(=O)c1ccc(Nc2ccc(O)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 7 |
| MolWt: | 453.51 | Num_heavy_atoms: | 31 |
| TPSA: | 145.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD42837
Formula: C15H17O3NS
Smiles:
CC(C)S(=O)(=O)c1ccc(Nc2ccc(O)cc2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 3.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 291.37 | Num_heavy_atoms: | 20 |
| TPSA: | 66.4 | NumAromaticRings: | 2 |
