Glycoside
GD002107
Name:
NoneFormula:
C22H26O9Smiles:
Cc1cc(-c2ccccc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc(C)c1OCC(=O)OAglycone:
Cc1cc(-c2ccccc2O)cc(C)c1OCC(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 7 |
| MolWt: | 434.44 | Num_heavy_atoms: | 31 |
| TPSA: | 145.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD02041
Formula: C16H16O4
Smiles:
Cc1cc(-c2ccccc2O)cc(C)c1OCC(=O)O| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.19 |
| AlogP: | 3.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 272.3 | Num_heavy_atoms: | 20 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
