Glycoside
GD139246
Name:
2-(hydroxymethyl)-6-(3-methoxy-4-methylphenoxy)oxane-3,4,5-triolFormula:
C14H20O7Smiles:
COc1cc(OC2OC(CO)C(O)C(O)C2O)ccc1CAglycone:
COc1cc(O)ccc1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 4 |
| MolWt: | 300.31 | Num_heavy_atoms: | 21 |
| TPSA: | 108.61 | NumAromaticRings: | 1 |
Unique Aglycone
AD56151
Formula: C8H10O2
Smiles:
COc1cc(O)ccc1C| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 1 |
| MolWt: | 138.17 | Num_heavy_atoms: | 10 |
| TPSA: | 29.46 | NumAromaticRings: | 1 |
