| Phytochemical Name : Forsythoside B |
| PCNDIDF0043 |
| Pubchem CID : 23928102 |
| Molecular formula: C34H44O19 |
| Canonical SMILES : CC1C(C(C(C(O1)OC2C(C(OC(C2OC(=O)C=CC3=CC(=C(C=C3)O)O)COC4C(C(CO4)(CO)O)O)OCCC5=CC(=C(C=C5)O)O)O)O)O)O |
Synonymes : Forsythoside B|81525-13-5|[(2R,3R,4R,5R,6R)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate|ForsythosideB|Forsythoside-B|MEGxp0_000314|ACon1_000521|GTPL10303|DTXSID101317304|HMS3886D20|HY-N0029|s9184|AKOS027250812|CCG-270442|CS-6503|NCGC00169000-01|AS-56592|(2R,3R,4R,5R,6R)-2-((((2R,3R,4R)-3,4-Dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl)oxy)methyl)-6-(3,4-dihydroxyphenethoxy)-5-hydroxy-4-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate|3,4-Dihydroxyphenethyl 6-O-D-apio-beta-D-furanosyl-4-O-[3-(3,4-dihydroxyphenyl)propenoyl]-3-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranoside |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.060 |
| Log Po/w (XLOGP3) : -1.730 |
| Log Po/w (WLOGP) : -2.660 |
| Log Po/w (MLOGP) : -3.930 |
| Log Po/w (SILICOS-IT) : -2.160 |
| Consensus Log Po/w : -1.490 |