| Phytochemical Name : Yinyanghuo A |
| PCNDIDY0005 |
| Pubchem CID : 5315393 |
| Molecular formula: C25H24O6 |
| Canonical SMILES : CC(=C)C(CC1=CC(=CC2=C1OC(C=C2)(C)C)C3=CC(=O)C4=C(C=C(C=C4O3)O)O)O |
Synonymes : Yinyanghuo A|174391-72-1|CHEBI:66492|5,7-dihydroxy-2-[8-(2-hydroxy-3-methylbut-3-enyl)-2,2-dimethylchromen-6-yl]chromen-4-one|4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(8-(2-hydroxy-3-methyl-3-butenyl)-2,2-dimethyl-2H-1-benzopyran-6-yl)-, (-)-|CHEMBL462969|SCHEMBL3679541|LMPK12110428|Q27135095|5,7-dihydroxy-8'-(2-hydroxy-3-methylbut-3-en-1-yl)-2',2'-dimethyl-2'H,4H-2,6'-bichromen-4-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.890 |
| Log Po/w (XLOGP3) : 4.820 |
| Log Po/w (WLOGP) : 4.430 |
| Log Po/w (MLOGP) : 1.830 |
| Log Po/w (SILICOS-IT) : 5.050 |
| Consensus Log Po/w : 4.000 |