Glycoside
GD089056
Name:
NoneFormula:
C18H22O8N2SSmiles:
O=C[C@H](NS(=O)(=O)c1ncccc1OCc1ccccc1)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
NS(=O)(=O)c1ncccc1OCc1ccccc1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 11 |
| MolWt: | 426.45 | Num_heavy_atoms: | 29 |
| TPSA: | 166.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD38765
Formula: C12H12O3N2S
Smiles:
NS(=O)(=O)c1ncccc1OCc1ccccc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 264.31 | Num_heavy_atoms: | 18 |
| TPSA: | 82.28 | NumAromaticRings: | 2 |
