| Phytochemical Name : Pinoresinol diglucoside |
| PCNDIDP0121 |
| Pubchem CID : 174003 |
| Molecular formula: C32H42O16 |
| Canonical SMILES : COC1=C(C=CC(=C1)C2C3COC(C3CO2)C4=CC(=C(C=C4)OC5C(C(C(C(O5)CO)O)O)O)OC)OC6C(C(C(C(O6)CO)O)O)O |
Synonymes : Pinoresinol diglucoside|63902-38-5|Pinoresinol diglucopyranoside|(2R,2'R,3S,3'S,4S,4'S,5R,5'R,6S,6'S)-6,6'-((((1S,3aR,4S,6aR)-tetrahydro-1H,3H-furo[3,4-c]furan-1,4-diyl)bis(2-methoxy-4,1-phenylene))bis(oxy))bis(2-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol)|Pinoresinoldiglucoside|Pinoresinol-diglucoside|(2S,3R,4S,5S,6R)-2-[4-[(3S,3aR,6S,6aR)-6-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol|CHEMBL450911|DTXSID50213522|HY-N0657|MFCD06656077|s9215|AKOS025311591|CCG-270370|AC-31295|Pinoresinol diglucoside, >=98% (HPLC)|Q-100734|beta-D-Glucopyranoside, (tetrahydro-1H,3H-furo(3,4-c)furan-1,4-diyl)bis(2-methoxy-4,1-phenylene) bis-, (1S-(1alpha,3aalpha,4alpha,6aalpha))- |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 3.230 |
| Log Po/w (XLOGP3) : -1.330 |
| Log Po/w (WLOGP) : -2.510 |
| Log Po/w (MLOGP) : -3.190 |
| Log Po/w (SILICOS-IT) : -1.590 |
| Consensus Log Po/w : -1.080 |

