| Phytochemical Name : (4alpha,5beta,6alpha,7alpha,10alpha)-1-Aromadendrene |
| PCNDIDOT0171 |
| Pubchem CID : 579031 |
| Molecular formula: C15H24 |
| Canonical SMILES : CC1CCC2C(C2(C)C)C3C1=CCC3C |
Synonymes : (4alpha,5beta,6alpha,7alpha,10alpha)-1-Aromadendrene|1-Aromadendrene|3,3,7,11-tetramethyl-tricyclo[6.3.0.0(2,4)]undec-8-ene|1,1,4,7-Tetramethyl-1a,2,3,4,6,7,7a,7b-octahydro-1H-cyclopropa[e]azulene|1,1,4,7-tetramethyl-1H,1aH,2H,3H,4H,6H,7H,7aH,7bH-cyclopropa[e]azulene|1H-Cycloprop[e]azulene, 1a,2,3,4,6,7,7a,7b-octahydro-1,1,4,7-tetramethyl-|[1aR-(1aalpha,4alpha,7alpha,7abeta,7balpha)]-1a,2,3,4,6,7,7a,7b-Octahydro-1,1,4,7-tetramethyl-1H-cycloprop[e]azulene |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.280 |
| Log Po/w (XLOGP3) : 4.440 |
| Log Po/w (WLOGP) : 4.270 |
| Log Po/w (MLOGP) : 5.650 |
| Log Po/w (SILICOS-IT) : 3.520 |
| Consensus Log Po/w : 4.230 |