| Phytochemical Name : (-)-Dihydroclusin |
| PCNDIDOT0013 |
| Pubchem CID : 332806 |
| Molecular formula: C22H28O7 |
| Canonical SMILES : COC1=CC(=CC(=C1OC)OC)CC(CO)C(CC2=CC3=C(C=C2)OCO3)CO |
Synonymes : (-)-dihydroclusin|73149-51-6|CHEMBL469916|NSC 332042|NSC-332042|(?)-Dihydroclusin|Dihydroclusin, (-)-|JZY8N27PKT|D06MLU|DTXSID10318502|BDBM50259874|NSC332042|(2R,3R)-2-(1,3-Benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]-1,4-butanediol|1,4-Butanediol, 2-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]-, (2R,3R)-|1,4-Butanediol, 2-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methyl]-, [R-(R*,R*)]- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.390 |
| Log Po/w (XLOGP3) : 3.010 |
| Log Po/w (WLOGP) : 2.440 |
| Log Po/w (MLOGP) : 1.480 |
| Log Po/w (SILICOS-IT) : 4.270 |
| Consensus Log Po/w : 2.920 |