Glycoside
GD115257
Name:
2-(hydroxymethyl)-6-(4-methoxy-2,5-dimethylphenoxy)oxane-3,4,5-triolFormula:
C15H22O7Smiles:
COc1cc(C)c(OC2OC(CO)C(O)C(O)C2O)cc1CAglycone:
COc1cc(C)c(O)cc1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 4 |
| MolWt: | 314.33 | Num_heavy_atoms: | 22 |
| TPSA: | 108.61 | NumAromaticRings: | 1 |
Unique Aglycone
AD45555
Formula: C9H12O2
Smiles:
COc1cc(C)c(O)cc1C| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 1 |
| MolWt: | 152.19 | Num_heavy_atoms: | 11 |
| TPSA: | 29.46 | NumAromaticRings: | 1 |
