Glycoside
GD069602
Name:
NoneFormula:
C16H17O6NSSmiles:
O=C(Nc1cccc(-c2cccs2)c1)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
Nc1cccc(-c2cccs2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 7 |
| MolWt: | 351.38 | Num_heavy_atoms: | 24 |
| TPSA: | 127.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD32988
Formula: C10H9NS
Smiles:
Nc1cccc(-c2cccs2)c1| HBA: | 1 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.0 | Num_rotatable_bonds: | 1 |
| MolWt: | 175.26 | Num_heavy_atoms: | 12 |
| TPSA: | 26.02 | NumAromaticRings: | 2 |
