| Phytochemical Name : beta-Santalene |
| PCNDIDB0090 |
| Pubchem CID : 10889018 |
| Molecular formula: C15H24 |
| Canonical SMILES : CC(=CCCC1(C2CCC(C2)C1=C)C)C |
Synonymes : BETA-SANTALENE|(-)-beta-Santalene|511-59-1|(1S-exo)-2-methyl-3-methylene-2-(4-methyl-3-pentenyl)bicyclo[2.2.1]heptane|(1S,2R,4R)-2-methyl-3-methylidene-2-(4-methylpent-3-en-1-yl)bicyclo[2.2.1]heptane|(1S,2R,4R)-2-methyl-3-methylidene-2-(4-methylpent-3-enyl)bicyclo[2.2.1]heptane|(-)-.beta.-Santalene|RG725C564C|Bicyclo(2.2.1)heptane, 2-methyl-3-methylene-2-(4-methyl-3-penten-1-yl)-, (1S,2R,4R)-|Bicyclo[2.2.1]heptane, 2-methyl-3-methylene-2-(4-methyl-3-penten-1-yl)-, (1S,2R,4R)-|Bicyclo[2.2.1]heptane, 2-methyl-3-methylene-2-(4-methyl-3-pentenyl)-, (1S,2R,4R)-|(-)-ss-Santalen|CHEBI:10440|DTXSID60883412|Bicyclo(2.2.1)heptane, 2-methyl-3-methylene-2-(4-methyl-3-pentenyl)-, (1S,2R,4R)-|(1S - exo) - 2 - methyl - 3 - methylene - 2 - (4 - methyl - 3 - pentenyl)bicyclo(2.2.1)heptane|C09718|Q27108639|(1S,2R,4R)-2-METHYL-3-METHYLENE-2-(4-METHYL-3-PENTEN-1-YL)BICYCLO(2.2.1)HEPTANE |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.350 |
| Log Po/w (XLOGP3) : 6.190 |
| Log Po/w (WLOGP) : 4.730 |
| Log Po/w (MLOGP) : 4.630 |
| Log Po/w (SILICOS-IT) : 4.550 |
| Consensus Log Po/w : 4.690 |