Glycoside
GD064083
Name:
NoneFormula:
C14H19O8NSSmiles:
O=S(=O)(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccc2c(c1)CCO2Aglycone:
NS(=O)(=O)c1ccc2c(c1)CCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -2.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 361.37 | Num_heavy_atoms: | 24 |
| TPSA: | 145.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD30826
Formula: C8H9O3NS
Smiles:
NS(=O)(=O)c1ccc2c(c1)CCO2| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 199.23 | Num_heavy_atoms: | 13 |
| TPSA: | 69.39 | NumAromaticRings: | 1 |
