| Phytochemical Name : Picein |
| PCNDIDP0112 |
| Pubchem CID : 92123 |
| Molecular formula: C14H18O7 |
| Canonical SMILES : CC(=O)C1=CC=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O |
Synonymes : Picein|530-14-3|Ameliaroside|L-picein|Salicinerein|Salinigrin|Piceoside|4-Acetylphenyl-b-D-glucopyranoside|4-ACETYLPHENYL BETA-D-GLUCOPYRANOSIDE|p-Hydroxyacetophenone-D-glucoside|UNII-2H3ACT49CQ|2H3ACT49CQ|CHEBI:8199|EINECS 208-473-7|1-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethanone|1-(4-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)ethanone|1192351-89-5|1-[4-(beta-D-Glucopyranosyloxy)phenyl]ethanone|1-(4-(beta-D-Glucopyranosyloxy)phenyl)ethan-1-one|1-[4-(beta-D-glucopyranosyloxy)phenyl]ethan-1-one|Ethanone, 1-[4-(.beta.-D-glucopyranosyloxy)phenyl]-|ETHANONE, 1-(4-(.BETA.-D-GLUCOPYRANOSYLOXY)PHENYL)-|Piccin|PICEIN [MI]|Picein, analytical standard|MLS002472970|SCHEMBL467772|CHEMBL1512620|DTXSID201031535|HMS2192O04|p-Acetylphenyl-.beta.-D-glucoside|4-Acetylphenyl ?-D-Glucopyranoside|HY-N8698|MFCD00016916|4-Acetylphenyl beta -D-Glucopyranoside|p-(acetylphenyl)-beta-D-glucopyranoside|NCGC00247461-01|NCGC00247461-02|SMR001397077|CS-0148944|4-ACETYLPHENYL .BETA.-D-GLUCOPYRANOSIDE|A829354|Ethanone, 1-(4-(beta-D-glucopyranosyloxy)phenyl)-|Q7190609|W-203003|1-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxyphenyl]ethanone|1-(4-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)phenyl)ethanone|1-(4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethan-1-one|1-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxyphenyl]ethanone|1194723-63-1 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.250 |
| Log Po/w (XLOGP3) : -0.680 |
| Log Po/w (WLOGP) : -0.930 |
| Log Po/w (MLOGP) : -1.310 |
| Log Po/w (SILICOS-IT) : -0.330 |
| Consensus Log Po/w : -0.400 |