| Phytochemical Name : Auriculoside |
| PCNDIDA0239 |
| Pubchem CID : 442260 |
| Molecular formula: C22H26O10 |
| Canonical SMILES : COC1=C(C=C(C=C1OC2C(C(C(C(O2)CO)O)O)O)C3CCC4=C(O3)C=C(C=C4)O)O |
Synonymes : Auriculoside|75871-96-4|7,3',5'-Trihydroxy-4'-methoxyflavan 3'-glucoside|C09478|AC1L9CIB|SureCN4743855|CHEBI:2929|SCHEMBL4743855|DTXSID50997254|(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(2S)-7-hydroxy-3,4-dihydro-2H-chromen-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol|Q27105886|3-Hydroxy-5-(7-hydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)-2-methoxyphenyl hexopyranoside|(2S,3R,4S,5S,6R)-2-(3-Hydroxy-5-((S)-7-hydroxychroman-2-yl)-2-methoxyphenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol|(2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(2S)-7-hydroxychroman-2-yl]-2-methoxy-phenoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol|(2S,3R,4S,5S,6R)-2-{3-hydroxy-5-[(2S)-7-hydroxy-3,4-dihydro-2H-1-benzopyran-2-yl]-2-methoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol|3-hydroxy-5-[(2S)-7-hydroxy-3,4-dihydro-2H-1-benzopyran-2-yl]-2-methoxyphenyl beta-D-glucopyranoside |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.090 |
| Log Po/w (XLOGP3) : 0.910 |
| Log Po/w (WLOGP) : 0.030 |
| Log Po/w (MLOGP) : -0.850 |
| Log Po/w (SILICOS-IT) : 0.260 |
| Consensus Log Po/w : 0.480 |

