Glycoside
GD082884
Name:
NoneFormula:
C15H18O9NClSSmiles:
COC(=O)c1ccc(Cl)cc1S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
COC(=O)c1ccc(Cl)cc1S(N)(=O)=OSugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -1.95 | Num_rotatable_bonds: | 9 |
| MolWt: | 411.82 | Num_heavy_atoms: | 26 |
| TPSA: | 170.46 | NumAromaticRings: | 1 |
Unique Aglycone
AD36948
Formula: C9H8O4NClS
Smiles:
COC(=O)c1ccc(Cl)cc1S(N)(=O)=O| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 2 |
| MolWt: | 249.67 | Num_heavy_atoms: | 15 |
| TPSA: | 86.46 | NumAromaticRings: | 1 |
