Glycoside
GD104572
Name:
NoneFormula:
C20H22O10S2Smiles:
COC(=O)[C@H](OS(=O)(=O)c1ccc(C)cc1)[C@@H](OS(=O)(=O)c1ccc(C)cc1)C(=O)OCAglycone:
Cc1ccc([S](=O)=O)cc1.Cc1ccc([S](=O)=O)cc1Sugarmoiety:
COC(=O)C(OO)C(OO)C(=O)OCOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.3 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 9 |
| MolWt: | 486.52 | Num_heavy_atoms: | 32 |
| TPSA: | 139.34 | NumAromaticRings: | 2 |
Unique Aglycone
AD00423
Formula: C7H7O2S
Smiles:
Cc1ccc([S](=O)=O)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 1 |
| MolWt: | 155.2 | Num_heavy_atoms: | 10 |
| TPSA: | 34.14 | NumAromaticRings: | 1 |
