| Phytochemical Name : Isodihydrofutoquinol A |
| PCNDIDI0061 |
| Pubchem CID : 25774970 |
| Molecular formula: C21H24O5 |
| Canonical SMILES : CC(CC1=CC2=C(C=C1)OCO2)C3(C=C(C(=O)C=C3OC)CC=C)OC |
Synonymes : Isodihydrofutoquinol A|62560-95-6|(4R)-4-[(2R)-1-(1,3-benzodioxol-5-yl)propan-2-yl]-4,5-dimethoxy-2-prop-2-enylcyclohexa-2,5-dien-1-one|AKOS032962677|(R)-2-Allyl-4,5-dimethoxy-4-[(R)-1-methyl-2-(1,3-benzodioxole-5-yl)ethyl]-2,5-cyclohexadiene-1-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.760 |
| Log Po/w (XLOGP3) : 3.680 |
| Log Po/w (WLOGP) : 3.590 |
| Log Po/w (MLOGP) : 1.990 |
| Log Po/w (SILICOS-IT) : 4.610 |
| Consensus Log Po/w : 3.530 |