Glycoside
GD016154
Name:
NoneFormula:
C13H18O8SSmiles:
Cc1ccc(S(=O)(=O)OC[C@@H]2OC(O)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
COS(=O)(=O)c1ccc(C)cc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | -1.5 | Num_rotatable_bonds: | 4 |
| MolWt: | 334.35 | Num_heavy_atoms: | 22 |
| TPSA: | 133.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD01798
Formula: C8H10O3S
Smiles:
COS(=O)(=O)c1ccc(C)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 186.23 | Num_heavy_atoms: | 12 |
| TPSA: | 43.37 | NumAromaticRings: | 1 |
