Glycoside
GD047107
Name:
NoneFormula:
C12H17O6NSSmiles:
Nc1ccccc1S[C@]1(O)O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
Nc1ccccc1SSugarmoiety:
OCC1OC(O)(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -1.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 303.34 | Num_heavy_atoms: | 20 |
| TPSA: | 136.4 | NumAromaticRings: | 1 |
Unique Aglycone
AD25401
Formula: C6H7NS
Smiles:
Nc1ccccc1S| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 0 |
| MolWt: | 125.2 | Num_heavy_atoms: | 8 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
