| Phytochemical Name : Isokaempferide |
| PCNDIDI0082 |
| Pubchem CID : 5280862 |
| Molecular formula: C16H12O6 |
| Canonical SMILES : COC1=C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O |
Synonymes : Isokaempferide|1592-70-7|3-Methoxyapigenin|3-Methylkaempferol|4-Vinylbenzylchloride|3-O-Methylkaempferol|Kaempferol 3-methyl ether|3-Methylkempferol|kaempferol-3-O-methyl ether|5,7-dihydroxy-2-(4-hydroxyphenyl)-3-methoxychromen-4-one|5,7,4'-trihydroxy-3-methoxyflavone|CHEBI:1579|CHEMBL165064|4H-1-BENZOPYRAN-4-ONE, 5,7-DIHYDROXY-2-(4-HYDROXYPHENYL)-3-METHOXY-|D0S6NP|MLS000877008|3-MK|MEGxp0_000171|SCHEMBL1628023|SCHEMBL4637442|ACon1_001687|cid_5280862|DTXSID90166609|HMS2271C11|BDBM50240899|LMPK12112688|AKOS032949069|Flavone, 4',5,7-trihydroxy-3-methoxy-|Isokaempferide, >=90% (LC/MS-ELSD)|SMR000440661|C05902|SR-01000780605|SR-01000780605-2|BRD-K52080570-001-01-2|Q27105473|5,7-Dihydroxy-2-(4-hydroxy-phenyl)-3-methoxy-chromen-4-one|5,7-dihydroxy-2-(4-hydroxyphenyl)-3-methoxy-chromen-4-one|5,7-dihydroxy-2-(4-hydroxyphenyl)-3-methoxy-4H-1-benzopyran-4-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.110 |
| Log Po/w (XLOGP3) : 2.220 |
| Log Po/w (WLOGP) : 2.590 |
| Log Po/w (MLOGP) : 0.220 |
| Log Po/w (SILICOS-IT) : 2.550 |
| Consensus Log Po/w : 1.940 |