| Phytochemical Name : Notopterol |
| PCNDIDN0103 |
| Pubchem CID : 5320227 |
| Molecular formula: C21H22O5 |
| Canonical SMILES : CC(=CC(CC(=CCOC1=C2C=CC(=O)OC2=CC3=C1C=CO3)C)O)C |
Synonymes : Notopterol|88206-46-6|(E)-4-((5-Hydroxy-3,7-dimethylocta-2,6-dien-1-yl)oxy)-7H-furo[3,2-g]chromen-7-one|CHEMBL258939|CHEBI:81136|7H-Furo(3,2-g)(1)benzopyran-7-one, 4-((5-hydroxy-3,7-dimethyl-2,6-octadienyl)oxy)-, (E)-|4-[(2E)-5-hydroxy-3,7-dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one|DTXSID101318526|HY-N0564|BDBM50375219|MFCD23701669|s9203|AKOS016010745|CCG-268084|AC-34568|AS-56212|CS-0009104|C17499|A862285|Q27155093|(E)-4-[(5-Hydroxy-3,7-dimethyl-2,6-octadien-1-yl)oxy]-7H-furo[3,2-g][1]benzopyran-7-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.750 |
| Log Po/w (XLOGP3) : 4.170 |
| Log Po/w (WLOGP) : 4.580 |
| Log Po/w (MLOGP) : 2.400 |
| Log Po/w (SILICOS-IT) : 4.840 |
| Consensus Log Po/w : 3.950 |