Glycoside
GD069585
Name:
NoneFormula:
C15H16O6N2SSmiles:
O=C(Nc1ccccc1-c1nccs1)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Nc1ccccc1-c1nccs1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 7 |
| MolWt: | 352.37 | Num_heavy_atoms: | 24 |
| TPSA: | 139.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD32993
Formula: C9H8N2S
Smiles:
Nc1ccccc1-c1nccs1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.39 | Num_rotatable_bonds: | 1 |
| MolWt: | 176.24 | Num_heavy_atoms: | 12 |
| TPSA: | 38.91 | NumAromaticRings: | 2 |
