Glycoside
GD069856
Name:
NoneFormula:
C18H22O8Smiles:
CC(=O)C(=Cc1ccc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1)C(C)=OAglycone:
CC(=O)C(=Cc1ccc(O)cc1)C(C)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 6 |
| MolWt: | 366.37 | Num_heavy_atoms: | 26 |
| TPSA: | 133.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD33092
Formula: C12H12O3
Smiles:
CC(=O)C(=Cc1ccc(O)cc1)C(C)=O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 1.95 | Num_rotatable_bonds: | 3 |
| MolWt: | 204.22 | Num_heavy_atoms: | 15 |
| TPSA: | 54.37 | NumAromaticRings: | 1 |
