Glycoside
GD098522
Name:
NoneFormula:
C20H23O9NSSmiles:
O=S(=O)(Nc1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1)c1ccc2c(c1)CCO2Aglycone:
O=S(=O)(Nc1ccc(O)cc1)c1ccc2c(c1)CCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -0.4 | Num_rotatable_bonds: | 6 |
| MolWt: | 453.47 | Num_heavy_atoms: | 31 |
| TPSA: | 154.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD41893
Formula: C14H13O4NS
Smiles:
O=S(=O)(Nc1ccc(O)cc1)c1ccc2c(c1)CCO2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 291.33 | Num_heavy_atoms: | 20 |
| TPSA: | 75.63 | NumAromaticRings: | 2 |
