| Phytochemical Name : Duartin |
| PCNDIDD0186 |
| Pubchem CID : 127790 |
| Molecular formula: C18H20O6 |
| Canonical SMILES : COC1=C(C(=C(C=C1)C2CC3=C(C(=C(C=C3)O)OC)OC2)OC)O |
Synonymes : Duartin|101311-04-0|7,3'-Dihydroxy-2',4',8-trimethoxyisoflavan|(3R)-3-(3-hydroxy-2,4-dimethoxyphenyl)-8-methoxy-3,4-dihydro-2H-chromen-7-ol|Spectrum_000810|SpecPlus_000888|Spectrum4_001602|Spectrum5_000323|KBioGR_001943|KBioSS_001290|DivK1c_006984|UM-9|GTPL11858|KBio1_001928|KBio2_001290|KBio2_003858|KBio2_006426|DTXSID60143841|GLXC-25963|2H-1-Benzopyran-7-ol, 3,4-dihydro-3-(3-hydroxy-2,4-dimethoxyphenyl)-8-methoxy-, (R)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.080 |
| Log Po/w (XLOGP3) : 2.880 |
| Log Po/w (WLOGP) : 2.840 |
| Log Po/w (MLOGP) : 1.240 |
| Log Po/w (SILICOS-IT) : 2.960 |
| Consensus Log Po/w : 2.600 |