| Phytochemical Name : Curculigoside |
| PCNDIDC0285 |
| Pubchem CID : 158845 |
| Molecular formula: C22H26O11 |
| Canonical SMILES : COC1=C(C(=CC=C1)OC)C(=O)OCC2=C(C=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O |
Synonymes : Curculigoside|85643-19-2|curculigoside A|A6S7X76UM5|[5-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,6-dimethoxybenzoate|beta-D-Glucopyranoside, 2-(((2,6-dimethoxybenzoyl)oxy)methyl)-4-hydroxyphenyl|beta-D-Glucopyranoside, 2-[[(2,6-dimethoxybenzoyl)oxy]methyl]-4-hydroxyphenyl|Curculigoside,(S)|UNII-A6S7X76UM5|CHEMBL258048|DTXSID30234896|HMS3886E06|HY-N0705|MFCD00800689|s5457|AKOS015897151|trihydroxy-6-(hydroxymethyl)tetrahydro|CCG-269418|C22-H26-O11|AC-33958|AS-56484|C3504|CS-0009721|Q-100862|Q5194662|5-hydroxy-2-((2S,3R,4S,5S,6R)-3,4,5-|2-(((2,6-DIMETHOXYBENZOYL)OXY)METHYL)-4-HYDROXYPHENYL .BETA.-D-GLUCOPYRANOSIDE|(5-Hydroxy-2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 2,6-dimethoxybenzoate|[5-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl2,6-dimethoxybenzoate |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.860 |
| Log Po/w (XLOGP3) : 0.700 |
| Log Po/w (WLOGP) : -0.210 |
| Log Po/w (MLOGP) : -0.880 |
| Log Po/w (SILICOS-IT) : 0.380 |
| Consensus Log Po/w : 0.370 |