Glycoside
GD059754
Name:
NoneFormula:
C14H15O6NSSmiles:
O=C(Nc1cc2ccccc2s1)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
Nc1cc2ccccc2s1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 6 |
| MolWt: | 325.34 | Num_heavy_atoms: | 22 |
| TPSA: | 127.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD29554
Formula: C8H7NS
Smiles:
Nc1cc2ccccc2s1| HBA: | 1 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.48 | Num_rotatable_bonds: | 0 |
| MolWt: | 149.22 | Num_heavy_atoms: | 10 |
| TPSA: | 26.02 | NumAromaticRings: | 2 |
