| Phytochemical Name : (1,7-Bis(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione) |
| PCNDIDOT0067 |
| Pubchem CID : 2889 |
| Molecular formula: C21H20O6 |
| Canonical SMILES : COC1=C(C=CC(=C1)C=CC(=O)CC(=O)C=CC2=CC(=C(C=C2)O)OC)O |
Synonymes : NCIMech_000700|KBioGR_002439|KBioSS_002445|MLS006011952|CHEMBL3187799|KBio2_002439|KBio2_005007|KBio2_007575|KBio3_002917|DTXSID10859369|Bio1_000405|Bio1_000894|Bio1_001383|HMS3372G15|HMS3873H13|91884-86-5|AKOS030228439|SB17248|SMP1_000082|NCGC00017159-08|NCGC00017159-13|NCI60_002883|SMR004703530|SY010906|FT-0607020|FT-0665233|FT-0688157|(1,7-bis(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione)|1,7-bis(4-hydroxy-3-methoxy-phenyl)hepta-1,6-diene-3,5-dione |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.270 |
| Log Po/w (XLOGP3) : 3.200 |
| Log Po/w (WLOGP) : 3.150 |
| Log Po/w (MLOGP) : 1.470 |
| Log Po/w (SILICOS-IT) : 4.040 |
| Consensus Log Po/w : 3.030 |