| Phytochemical Name : (5R,6R,7R)-5-(4-hydroxyphenyl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalene-2,3-diol |
| PCNDIDOT0183 |
| Pubchem CID : 5317329 |
| Molecular formula: C18H20O3 |
| Canonical SMILES : CC1CC2=CC(=C(C=C2C(C1C)C3=CC=C(C=C3)O)O)O |
Synonymes : (1R,2R,3R)-1-(4-hydroxyphenyl)-2,3-dimethyl-tetralin-6,7-diol|CHEMBL464458|3'-Demethoxy-6-O-demethylisoguaiacin|(5R,6R,7R)-5-(4-hydroxyphenyl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalene-2,3-diol|71113-16-1 |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.400 |
| Log Po/w (XLOGP3) : 4.190 |
| Log Po/w (WLOGP) : 3.760 |
| Log Po/w (MLOGP) : 2.930 |
| Log Po/w (SILICOS-IT) : 3.170 |
| Consensus Log Po/w : 3.290 |