| Phytochemical Name : Acetic acid cedrol ester |
| PCNDIDA0010 |
| Pubchem CID : 6482 |
| Molecular formula: C17H28O2 |
| Canonical SMILES : CC1CCC2C13CCC(C(C3)C2(C)C)(C)OC(=O)C |
Synonymes : Cedryl acetate|Cedranyl acetate|Acetic acid, cedrol ester|8beta-H-Cedran-8-ol acetate|EINECS 201-036-1|8-beta-H-CEDRAN-8-OL, ACETATE|77-54-3|AI3-24206|Cedryl Acetate-50%|acetic acid cedrol ester|SCHEMBL1532502|1H-3a,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-, acetate|(3R-(3alpha,3Abeta,6alpha,7beta,8aalpha))-octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-5-yl acetate|1H-3a,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-, acetate, (3R,3aS,6R,7R,8aS)-|Octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-yl acetate, (3R-(3alpha,3abeta,6alpha,7beta,8aalpha))-|AKOS026750628|LS-2623 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.390 |
| Log Po/w (XLOGP3) : 4.460 |
| Log Po/w (WLOGP) : 4.180 |
| Log Po/w (MLOGP) : 4.040 |
| Log Po/w (SILICOS-IT) : 3.830 |
| Consensus Log Po/w : 3.980 |