| Phytochemical Name : Zeylenol |
| PCNDIDZ0005 |
| Pubchem CID : 10992619 |
| Molecular formula: C21H20O7 |
| Canonical SMILES : C1=CC=C(C=C1)C(=O)OCC2(C(C=CC(C2O)OC(=O)C3=CC=CC=C3)O)O |
Synonymes : ZEYLENOL|78804-17-8|(-)-Zeylenol|((1R,2S,5R,6S)-5-(Benzoyloxy)-1,2,6-trihydroxycyclohex-3-en-1-yl)methyl benzoate|[(1R,2S,5R,6S)-5-benzoyloxy-1,2,6-trihydroxycyclohex-3-en-1-yl]methyl benzoate|((1R,2S,5R,6S)-5-(Benzoyloxy)-1,2,6-trihydroxycyclo-hex-3-en-1-yl)methyl benzoate|CHEMBL4469789|DTXSID70451085|HY-N2052|MFCD23701743|AKOS016010698|CS-0018541|A864959|((1R,2S,5R,6S)-5-(Benzoyloxy)-1,2,6-trihydroxycyclohex-3-en-1-yl)methylbenzoate|(1R,4S,5R,6S)-5-[(Benzoyloxy)methyl]-4,5,6-trihydroxycyclohex-2-en-1-yl benzoate |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.880 |
| Log Po/w (XLOGP3) : 1.520 |
| Log Po/w (WLOGP) : 1.090 |
| Log Po/w (MLOGP) : 1.440 |
| Log Po/w (SILICOS-IT) : 1.340 |
| Consensus Log Po/w : 1.660 |