ethyl 3-(4-hydroxy-3,5-dimethoxyphenyl)-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate
Chemical Structure Depiction of
ethyl 3-(4-hydroxy-3,5-dimethoxyphenyl)-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate
ethyl 3-(4-hydroxy-3,5-dimethoxyphenyl)-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate
Compound characteristics
| Compound ID: | 8020-7078 |
| Compound Name: | ethyl 3-(4-hydroxy-3,5-dimethoxyphenyl)-3-[3-hydroxy-6-(hydroxymethyl)-4-oxo-4H-pyran-2-yl]propanoate |
| Molecular Weight: | 394.38 |
| Molecular Formula: | C19 H22 O9 |
| Smiles: | CCOC(CC(C1=C(C(C=C(CO)O1)=O)O)c1cc(c(c(c1)OC)O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5582 |
| logD: | 0.4675 |
| logSw: | -1.2118 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.464 |
| InChI Key: | NNXPKDALTADKCJ-LBPRGKRZSA-N |