Glycoside
GD146842
Name:
2-[1-(3,4-dimethoxyphenyl)-2-hydroxyethoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H24O9Smiles:
COc1ccc(C(CO)OC2OC(CO)C(O)C(O)C2O)cc1OCAglycone:
COc1ccc(C(O)CO)cc1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.45 | Num_rotatable_bonds: | 7 |
| MolWt: | 360.36 | Num_heavy_atoms: | 25 |
| TPSA: | 138.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD47690
Formula: C10H14O4
Smiles:
COc1ccc(C(O)CO)cc1OC| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 0.73 | Num_rotatable_bonds: | 4 |
| MolWt: | 198.22 | Num_heavy_atoms: | 14 |
| TPSA: | 58.92 | NumAromaticRings: | 1 |
