Glycoside
GD000643
Name:
NoneFormula:
C20H17O9Smiles:
O=C1c2cccc([O-])c2C(=O)c2c(OC3OC(CO)C(O)C(O)C3O)cccc21Aglycone:
O=C1c2cccc([O-])c2C(=O)c2c(O)cccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.3 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 401.35 | Num_heavy_atoms: | 29 |
| TPSA: | 156.58 | NumAromaticRings: | 2 |
Unique Aglycone
AD00697
Formula: C14H7O4
Smiles:
O=C1c2cccc([O-])c2C(=O)c2c(O)cccc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 0 |
| MolWt: | 239.21 | Num_heavy_atoms: | 18 |
| TPSA: | 77.43 | NumAromaticRings: | 2 |
