Glycoside
GD078449
Name:
NoneFormula:
C17H22O6NClSSmiles:
C[C@@H](CC(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)Sc1ccc(Cl)cc1Aglycone:
CC(CC(N)=O)Sc1ccc(Cl)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | 0.13 | Num_rotatable_bonds: | 6 |
| MolWt: | 391.87 | Num_heavy_atoms: | 25 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD36025
Formula: C11H12ONClS
Smiles:
CC(CC(N)=O)Sc1ccc(Cl)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 2.7 | Num_rotatable_bonds: | 4 |
| MolWt: | 229.73 | Num_heavy_atoms: | 14 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
