| Phytochemical Name : Pterosin B |
| PCNDIDP0208 |
| Pubchem CID : 115049 |
| Molecular formula: C14H18O2 |
| Canonical SMILES : CC1CC2=C(C1=O)C(=C(C(=C2)C)CCO)C |
Synonymes : Pterosin B|34175-96-7|BI 2|(2R)-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one|(R)-6-(2-Hydroxyethyl)-2,5,7-trimethyl-2,3-dihydro-1H-inden-1-one|1H-Inden-1-one, 2,3-dihydro-6-(2-hydroxyethyl)-2,5,7-trimethyl-, (R)-|1-Indanone, 6-(2-hydroxyethyl)-2,5,7-trimethyl-, (-)-|PterosinB|(2r)-6-(2-hydroxyethyl)-2,5,7-trimethyl-1-indanone|MLS002473104|1H-Inden-1-one, 2,3-dihydro-6-(2-hydroxyethyl)-2,5,7-trimethyl-,(R)-|CHEMBL1728959|DTXSID70955715|HMS2267D21|HY-N1570|AKOS032949095|NCGC00247487-01|LS-81328|MS-23206|SMR001397206|CS-0017119|F82087|(2R)-6-(2-hydroxyethyl)-2,5,7-trimethyl-indan-1-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.380 |
| Log Po/w (XLOGP3) : 2.540 |
| Log Po/w (WLOGP) : 2.210 |
| Log Po/w (MLOGP) : 2.190 |
| Log Po/w (SILICOS-IT) : 3.990 |
| Consensus Log Po/w : 2.660 |