Glycoside
GD076422
Name:
NoneFormula:
C14H18O8NClSSmiles:
COc1ccc(S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)cc1ClAglycone:
COc1ccc(S(N)(=O)=O)cc1ClSugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -1.73 | Num_rotatable_bonds: | 9 |
| MolWt: | 383.81 | Num_heavy_atoms: | 24 |
| TPSA: | 153.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD34276
Formula: C8H8O3NClS
Smiles:
COc1ccc(S(N)(=O)=O)cc1Cl| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.0 | Num_rotatable_bonds: | 2 |
| MolWt: | 221.66 | Num_heavy_atoms: | 13 |
| TPSA: | 69.39 | NumAromaticRings: | 1 |
