Glycoside
GD067380
Name:
NoneFormula:
C13H17O7N2ClSSmiles:
Cc1cc(Cl)ncc1S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
Cc1cc(Cl)ncc1S(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: | -2.04 | Num_rotatable_bonds: | 8 |
| MolWt: | 368.8 | Num_heavy_atoms: | 23 |
| TPSA: | 157.05 | NumAromaticRings: | 1 |
Unique Aglycone
AD30938
Formula: C7H7O2N2ClS
Smiles:
Cc1cc(Cl)ncc1S(N)(=O)=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 1 |
| MolWt: | 206.65 | Num_heavy_atoms: | 12 |
| TPSA: | 73.05 | NumAromaticRings: | 1 |
