Glycoside
GD036566
Name:
NoneFormula:
C22H23O8ClSSmiles:
O=S1(=O)CCOc2ccc(Cc3cc([C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)ccc3Cl)cc21Aglycone:
O=S1(=O)CCOc2ccc(Cc3ccccc3Cl)cc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 470.93 | Num_heavy_atoms: | 31 |
| TPSA: | 133.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD23050
Formula: C16H13O3ClS
Smiles:
O=S1(=O)CCOc2ccc(Cc3ccccc3Cl)cc21| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.2 |
| AlogP: | 3.1 | Num_rotatable_bonds: | 2 |
| MolWt: | 308.79 | Num_heavy_atoms: | 20 |
| TPSA: | 43.37 | NumAromaticRings: | 2 |
