Glycoside
GD069210
Name:
NoneFormula:
C16H21O7NSSmiles:
CCC(=O)C(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
CCC(=O)C(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 6 |
| MolWt: | 371.41 | Num_heavy_atoms: | 25 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD32834
Formula: C10H11O2NS
Smiles:
CCC(=O)C(=O)Nc1ccc(S)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 209.27 | Num_heavy_atoms: | 14 |
| TPSA: | 46.17 | NumAromaticRings: | 1 |
