Glycoside
GD026002
Name:
NoneFormula:
C20H20O10Smiles:
O=C(O)c1cc(C(=O)O)cc(-c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)c1Aglycone:
O=C(O)c1cc(C(=O)O)cc(-c2ccc(O)cc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.3 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 6 |
| MolWt: | 420.37 | Num_heavy_atoms: | 30 |
| TPSA: | 173.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD17174
Formula: C14H10O5
Smiles:
O=C(O)c1cc(C(=O)O)cc(-c2ccc(O)cc2)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 258.23 | Num_heavy_atoms: | 19 |
| TPSA: | 94.83 | NumAromaticRings: | 2 |
