Glycoside
GD029946
Name:
NoneFormula:
C20H26O6SSmiles:
CCOc1ccc(Cc2sc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2C)cc1Aglycone:
CCOc1ccc(Cc2sccc2C)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 6 |
| MolWt: | 394.49 | Num_heavy_atoms: | 27 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD19423
Formula: C14H16OS
Smiles:
CCOc1ccc(Cc2sccc2C)cc1| HBA: | 1 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 4.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 232.35 | Num_heavy_atoms: | 16 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
