| Phytochemical Name : (3R-(3alpha,3abeta,6alpha,7beta,8beta,8aalpha))-Octahydro-6-hydroxy-3,6,8-trimethyl-1H-3a,7-methanoazulene-8-methanol alpha-acetate |
| PCNDIDOT0155 |
| Pubchem CID : 102490253 |
| Molecular formula: C17H28O3 |
| Canonical SMILES : CC1CCC2C13CCC(C(C3)C2(C)COC(=O)C)(C)O |
Synonymes : 14-Acetoxycedrol|65557-98-4|(3R-(3alpha,3abeta,6alpha,7beta,8beta,8aalpha))-Octahydro-6-hydroxy-3,6,8-trimethyl-1H-3a,7-methanoazulene-8-methanol alpha-acetate|1H-3a,7-Methanoazulene-8-methanol, octahydro-6-hydroxy-3,6,8-trimethyl-, alpha-acetate, (3R-(3alpha,3abeta,6alpha,7beta,8beta,8aalpha))-|(3R,3aS,6R,7R,8R,8aR)-2,3,4,5,6,7,8,8a-Octahydro-6-hydroxy-3,6,8-trimethyl-1H-3a,7-methanoazulene-8-methanol 8-acetate |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.050 |
| Log Po/w (XLOGP3) : 3.230 |
| Log Po/w (WLOGP) : 3.150 |
| Log Po/w (MLOGP) : 3.160 |
| Log Po/w (SILICOS-IT) : 3.220 |
| Consensus Log Po/w : 3.160 |