Glycoside
GD023939
Name:
NoneFormula:
C19H19O8Smiles:
O=C([O-])c1ccc(-c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cc1Aglycone:
O=C([O-])c1ccc(-c2ccc(O)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | -1.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 375.35 | Num_heavy_atoms: | 27 |
| TPSA: | 139.51 | NumAromaticRings: | 2 |
Unique Aglycone
AD16047
Formula: C13H9O3
Smiles:
O=C([O-])c1ccc(-c2ccc(O)cc2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 213.21 | Num_heavy_atoms: | 16 |
| TPSA: | 60.36 | NumAromaticRings: | 2 |
