Glycoside
GD091121
Name:
NoneFormula:
C19H23O8NSSmiles:
O=S(=O)(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccc(OCc2ccccc2)cc1Aglycone:
NS(=O)(=O)c1ccc(OCc2ccccc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 7 |
| MolWt: | 425.46 | Num_heavy_atoms: | 29 |
| TPSA: | 145.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD39717
Formula: C13H13O3NS
Smiles:
NS(=O)(=O)c1ccc(OCc2ccccc2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 4 |
| MolWt: | 263.32 | Num_heavy_atoms: | 18 |
| TPSA: | 69.39 | NumAromaticRings: | 2 |
