| Phytochemical Name : Dihydro-beta-agarofuran |
| PCNDIDD0123 |
| Pubchem CID : 21593552 |
| Molecular formula: C15H26O |
| Canonical SMILES : CC1CCCC2(C13CC(CC2)C(O3)(C)C)C |
Synonymes : Dihydro-beta-agarofuran|Deoxybaimuxinol|Dihydroagarofuran|trans-Dihydroagarofuran|beta-Agarofuran, dihydro-|5956-09-2|2H-3,9a-Methano-1-benzoxepin, octahydro-2,2,5a,9-tetramethyl-|Octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin|(1S,2R,6S,9R)-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecane|(3R,5aS,9R,9aS)-2,2,5a,9-tetramethyloctahydro-2H-3,9a-methano-1-benzoxepine|SCHEMBL2400604|CHEBI:71547|Q27139701 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.430 |
| Log Po/w (XLOGP3) : 3.140 |
| Log Po/w (WLOGP) : 2.010 |
| Log Po/w (MLOGP) : 2.870 |
| Log Po/w (SILICOS-IT) : 3.050 |
| Consensus Log Po/w : 2.900 |