Glycoside
GD007116
Name:
NoneFormula:
C21H17O8Cl2Smiles:
O=C([O-])c1ccc(-c2c(Cl)cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2Cl)cc1Aglycone:
O=C([O-])c1ccc(-c2c(Cl)cc(O)cc2Cl)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | 0.2 | Num_rotatable_bonds: | 5 |
| MolWt: | 444.24 | Num_heavy_atoms: | 29 |
| TPSA: | 139.51 | NumAromaticRings: | 2 |
Unique Aglycone
AD05816
Formula: C15H7O3Cl2
Smiles:
O=C([O-])c1ccc(-c2c(Cl)cc(O)cc2Cl)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.73 | Num_rotatable_bonds: | 2 |
| MolWt: | 282.1 | Num_heavy_atoms: | 18 |
| TPSA: | 60.36 | NumAromaticRings: | 2 |
