Glycoside
GD030300
Name:
NoneFormula:
C25H28O9Smiles:
CCc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(C(=O)CCc2ccc3occc3c2)c1OAglycone:
CCc1ccc(O)c(C(=O)CCc2ccc3occc3c2)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 8 |
| MolWt: | 472.49 | Num_heavy_atoms: | 34 |
| TPSA: | 149.82 | NumAromaticRings: | 3 |
Unique Aglycone
AD19608
Formula: C19H18O4
Smiles:
CCc1ccc(O)c(C(=O)CCc2ccc3occc3c2)c1O| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 4.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 310.35 | Num_heavy_atoms: | 23 |
| TPSA: | 70.67 | NumAromaticRings: | 3 |
