Glycoside
GD089049
Name:
NoneFormula:
C14H20O8NSBrSmiles:
CCOc1ccc(Br)cc1S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
CCOc1ccc(Br)cc1S(N)(=O)=OSugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 10 |
| MolWt: | 442.28 | Num_heavy_atoms: | 25 |
| TPSA: | 153.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD38733
Formula: C8H10O3NSBr
Smiles:
CCOc1ccc(Br)cc1S(N)(=O)=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 280.14 | Num_heavy_atoms: | 14 |
| TPSA: | 69.39 | NumAromaticRings: | 1 |
