Glycoside
GD082205
Name:
NoneFormula:
C16H25O9NSSmiles:
CCOCCS(=O)(=O)Nc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
CCOCCS(=O)(=O)Nc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.36 | Num_rotatable_bonds: | 9 |
| MolWt: | 407.44 | Num_heavy_atoms: | 27 |
| TPSA: | 154.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD36917
Formula: C10H15O4NS
Smiles:
CCOCCS(=O)(=O)Nc1ccc(O)cc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 245.3 | Num_heavy_atoms: | 16 |
| TPSA: | 75.63 | NumAromaticRings: | 1 |
