Glycoside
GD058794
Name:
NoneFormula:
C11H17O7NS2Smiles:
Cc1ccsc1S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
Cc1ccsc1S(N)(=O)=OSugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -2.02 | Num_rotatable_bonds: | 8 |
| MolWt: | 339.39 | Num_heavy_atoms: | 21 |
| TPSA: | 144.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD28806
Formula: C5H7O2NS2
Smiles:
Cc1ccsc1S(N)(=O)=O| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 0.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 177.25 | Num_heavy_atoms: | 10 |
| TPSA: | 60.16 | NumAromaticRings: | 1 |
