| Phytochemical Name : Coniferin |
| PCNDIDC0232 |
| Pubchem CID : 5280372 |
| Molecular formula: C16H22O8 |
| Canonical SMILES : COC1=C(C=CC(=C1)C=CCO)OC2C(C(C(C(O2)CO)O)O)O |
Synonymes : Coniferin|531-29-3|Abietin|Laricin|Coniferoside|Coniferyl alcohol beta-D-glucoside|4-(3-hydroxyprop-1-en-1-yl)-2-methoxyphenyl beta-D-glucopyranoside|UNII-M6616XLU2J|124151-33-3|CHEMBL459056|M6616XLU2J|coniferyl alcohol-4-O-beta-D-glucopyranoside|CHEBI:16220|(E)-coniferin|(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[(E)-3-hydroxyprop-1-enyl]-2-methoxyphenoxy]oxane-3,4,5-triol|(2R,3S,4S,5R,6S)-2-(Hydroxymethyl)-6-(4-((E)-3-hydroxyprop-1-en-1-yl)-2-methoxyphenoxy)tetrahydro-2H-pyran-3,4,5-triol|3-(4-beta-D-Glucopyranosyloxy-3-methoxyphenyl)-2-propen-1-ol|C16H22O8|beta-D-Glucopyranoside, 4-(3-hydroxy-1-propenyl)-2-methoxyphenyl (VAN)|C16-H22-O8|(2R,3S,4S,5R,6S)-2-(HYDROXYMETHYL)-6-(4-((E)-3-HYDROXYPROP-1-ENYL)-2-METHOXYPHENOXY)OXANE-3,4,5-TRIOL|CONIFERIN [MI]|bmse000608|MLS000563468|SCHEMBL321115|4-hydroxy-3-methoxy-1-(gamma-hydroxypropenyl)benzene-4-D-glucoside|MEGxp0_000873|ACon1_002032|HMS2267N17|HY-N3617|BDBM50269612|Coniferyl alcohol beta-delta-glucoside|AKOS032948392|4-O-(beta-D-glucosyl)-trans-coniferol|NCGC00179896-01|NCGC00179896-02|MS-25232|SMR000470885|CONIFERYL ALCOHOL .BETA.-D-GLUCOSIDE|CS-0023945|C00761|E80725|Q358968|BRD-K70130576-001-01-7|4-(3-Hydroxyprop-1-en-1-yl)-2-methoxyphenyl beta-delta-glucopyranoside|(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{4-[(1E)-3-hydroxyprop-1-en-1-yl]-2-methoxyphenoxy}oxane-3,4,5-triol |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.140 |
| Log Po/w (XLOGP3) : -1.280 |
| Log Po/w (WLOGP) : -1.230 |
| Log Po/w (MLOGP) : -1.320 |
| Log Po/w (SILICOS-IT) : -0.210 |
| Consensus Log Po/w : -0.380 |