| Phytochemical Name : Dehydropipernonaline |
| PCNDIDD0046 |
| Pubchem CID : 6439947 |
| Molecular formula: C21H25NO3 |
| Canonical SMILES : C1CCN(CC1)C(=O)C=CC=CCCC=CC2=CC3=C(C=C2)OCO3 |
Synonymes : Dehydropipernonaline|107584-38-3|Dehydropipernoline|(2E,4E,8E)-9-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylnona-2,4,8-trien-1-one|N-(9-(3,4-Methylenedioxyphenyl)-2,4,8-nonatrienoyl)piperidine|Piperidine, 1-(9-(1,3-benzodioxol-5-yl)-1-oxo-2,4,8-nonatrienyl)-, (E,E,E)-|Piperidine, 1-[9-(1,3-benzodioxol-5-yl)-1-oxo-2,4,8-nonatrienyl]-, (E,E,E)-|D0H0FG|CHEMBL483708|CHEBI:174566|DTXSID401315333|BDBM50479136|AKOS040736372|9-(3,4-Methylenedioxy)-2,4,8-nonatrienoic acid piperidide|(2E,4E,8E)-9-(Benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)nona-2,4,8-trien-1-one|2,4,8-Nonatrien-1-one, 9-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-, (2E,4E,8E)-|Piperidine, 1-[(2E,4E,8E)-9-(1,3-benzodioxol-5-yl)-1-oxo-2,4,8-nonatrienyl]-|(2E,4E,8E)-9-(2H-1,3-BENZODIOXOL-5-YL)-1-(PIPERIDIN-1-YL)NONA-2,4,8-TRIEN-1-ONE |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 4.700 |
| Log Po/w (XLOGP3) : 8.720 |
| Log Po/w (WLOGP) : 6.890 |
| Log Po/w (MLOGP) : 5.030 |
| Log Po/w (SILICOS-IT) : 6.830 |
| Consensus Log Po/w : 6.430 |