Glycoside
GD012888
Name:
2-(hydroxymethyl)-6-({5-methoxy-[1,1'-biphenyl]-3',4'-diyl}oxy)oxane-3,4,5-triolFormula:
C19H22O9Smiles:
COc1cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc(-c2ccc(O)c(O)c2)c1Aglycone:
COc1cc(O)cc(-c2ccc(O)c(O)c2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.37 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 394.38 | Num_heavy_atoms: | 28 |
| TPSA: | 149.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD09677
Formula: C13H12O4
Smiles:
COc1cc(O)cc(-c2ccc(O)c(O)c2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | 2.48 | Num_rotatable_bonds: | 2 |
| MolWt: | 232.24 | Num_heavy_atoms: | 17 |
| TPSA: | 69.92 | NumAromaticRings: | 2 |
