Glycoside
GD078875
Name:
NoneFormula:
C19H25O6NSSmiles:
C=C1CC(C)(C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@H]3O)cc2)C1Aglycone:
C=C1CC(C)(C(=O)Nc2ccc(S)cc2)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 5 |
| MolWt: | 395.48 | Num_heavy_atoms: | 27 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD36239
Formula: C13H15ONS
Smiles:
C=C1CC(C)(C(=O)Nc2ccc(S)cc2)C1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.31 |
| AlogP: | 3.27 | Num_rotatable_bonds: | 2 |
| MolWt: | 233.34 | Num_heavy_atoms: | 16 |
| TPSA: | 29.1 | NumAromaticRings: | 1 |
