| Phytochemical Name : beta-Caryophyllene alcohol |
| PCNDIDB0067 |
| Pubchem CID : 61125 |
| Molecular formula: C15H26O |
| Canonical SMILES : CC1(CC2C1CCC3(CCCC2(C3)O)C)C |
Synonymes : beta-Caryophyllene alcohol|Caryophyllenol|4,4,8-trimethyltricyclo[6.3.1.02,5]dodecan-1-ol|472-97-9|beta-Caryolanol|4,4,8-Trimethyltricyclo(6.3.1.02,5)dodecan-1-ol|beta-caryolan-1-ol|Spectrum_000678|SpecPlus_000224|Spectrum2_001727|Spectrum3_001279|Spectrum4_001455|Spectrum5_000069|BSPBio_002878|KBioGR_001969|KBioSS_001158|SPECTRUM300105|4,4,8 - trimethyltricyclo(6.3.1.02,5)dodecan - 1 - ol|DivK1c_006320|SPBio_001774|SCHEMBL3508459|CHEMBL1374805|KBio1_001264|KBio2_001158|KBio2_003726|KBio2_006294|KBio3_002378|DTXSID00861976|Tricyclo(6.3.1.0(2,5)-)dodecan-1-ol, 4,4,8-trimethyl-, (1R-(1alpha,2alpha,5beta,8beta))-|Tricyclo[6.3.1.02,5]dodecan-1-ol, 4,4,8-trimethyl-, [1R-(1.alpha.,2.alpha.,5.beta.,8.beta.)]-|CCG-38795|SDCCGMLS-0066495.P001|NCGC00095583-01|NCGC00095583-02|SR-05000002464|SR-05000002464-1|4,4,8-Trimethyl-Tricyclo(6.3.1.02,5)dodecan-1-ol|4,4,8-Trimethyltricyclo[6.3.1.02,5]dodecan-1-ol, 9CI|Ethyl 5-methoxy-2-(1-piperidinylmethyl)-1-benzofuran-3-carboxylate|82008-48-8 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.000 |
| Log Po/w (XLOGP3) : 4.160 |
| Log Po/w (WLOGP) : 3.750 |
| Log Po/w (MLOGP) : 3.810 |
| Log Po/w (SILICOS-IT) : 3.570 |
| Consensus Log Po/w : 3.660 |