Glycoside
GD007287
Name:
NoneFormula:
C19H22O8SSmiles:
CS(=O)(=O)c1ccc(-c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cc1Aglycone:
CS(=O)(=O)c1ccc(-c2ccc(O)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 410.44 | Num_heavy_atoms: | 28 |
| TPSA: | 133.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD05943
Formula: C13H12O3S
Smiles:
CS(=O)(=O)c1ccc(-c2ccc(O)cc2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 2 |
| MolWt: | 248.3 | Num_heavy_atoms: | 17 |
| TPSA: | 54.37 | NumAromaticRings: | 2 |
