| Phytochemical Name : Casticin |
| PCNDIDC0071 |
| Pubchem CID : 5315263 |
| Molecular formula: C19H18O8 |
| Canonical SMILES : COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)O)OC)O |
Synonymes : Casticin|Vitexicarpin|479-91-4|Quercetagetin 3,6,7,4'-tetramethyl ether|5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxychromen-4-one|3',5-Dihydroxy-3,4',6,7-tetramethoxyflavone|UNII-753GT729OU|3,6,7,4'-Tetra-O-methyl-5,3'-dihydroxyflavone|CHEBI:69355|753GT729OU|DTXSID80197326|5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-4H-1-benzopyran-4-one|4H-1-Benzopyran-4-one, 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-|CASTICIN (USP-RS)|CASTICIN [USP-RS]|5-hydroxy-2-(3-hydroxy-4-methoxy-phenyl)-3,6,7-trimethoxy-chromen-4-one|5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-4H-chromen-4-one|Casticin(Vitexicarpin)|Casticin, analytical standard|SCHEMBL382354|CHEMBL452767|DTXCID90119817|3,6,7,4'-tetramethylquercetagetin|HY-N0516|LMPK12113010|MFCD00210481|s9288|AKOS015896773|AC-6085|CCG-268348|NCGC00482751-01|CS-0009055|FT-0688327|5,12-Dihydroxy-2,6,7,13-tetramethoxyflavone|5,3'-dihydroxy-3,6,7,4'-tetramethoxyflavone|Casticin, primary pharmaceutical reference standard|Q-100515|Q15228129|Casticin, United States Pharmacopeia (USP) Reference Standard|5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-4H-benzopyran-4-one, 9CI |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 3.440 |
| Log Po/w (XLOGP3) : 3.120 |
| Log Po/w (WLOGP) : 2.910 |
| Log Po/w (MLOGP) : -0.120 |
| Log Po/w (SILICOS-IT) : 3.190 |
| Consensus Log Po/w : 2.510 |

