| Phytochemical Name : Ginsenoyne E |
| PCNDIDG0089 |
| Pubchem CID : 5320336 |
| Molecular formula: C17H22O2 |
| Canonical SMILES : CCCCCCCC1C(O1)CC#CC#CC(=O)C=C |
Synonymes : Ginsenoyne E|8-(3-heptyloxiran-2-yl)oct-1-en-4,6-diyn-3-one|PQ 3|9,10-Epoxy-1-heptadecene-4,6-diyn-3-one|126146-63-2|3-Oxopanaxydol|Panaquinquecol 3|SCHEMBL10493749|CHEBI:173842|8-(3-Heptyloxiranyl)-1-octene-4,6-diyn-3-one, 9CI|1-Octene-4,6-diyn-3-one, 8-[(2R,3S)-3-heptyloxiranyl]-|8-((2R,3S)-3-Heptyloxiran-2-yl)octa-1-en-4,6-diyn-3-one|1-Octene-4,6-diyn-3-one, 8-(3-heptyloxiranyl)-, (2R-cis)-|1-Octene-4,6-diyn-3-one, 8-[(2R,3S)-3-heptyl-2-oxiranyl]- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 4.100 |
| Log Po/w (XLOGP3) : 5.000 |
| Log Po/w (WLOGP) : 3.430 |
| Log Po/w (MLOGP) : 2.940 |
| Log Po/w (SILICOS-IT) : 5.110 |
| Consensus Log Po/w : 4.110 |