| Phytochemical Name : Mitraphyllic acid |
| PCNDIDM0133 |
| Pubchem CID : 193449 |
| Molecular formula: C20H22N2O4 |
| Canonical SMILES : CC1C2CN3CCC4(C3CC2C(=CO1)C(=O)O)C5=CC=CC=C5NC4=O |
Synonymes : Mitraphyllic acid|10126-00-8|Isomitraphyllic acid|DTXSID80906031|(1S,4aS,5aS,6R,10aR)-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylic acid|Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, (19alpha)-|2-Hydroxy-19-methyl-1,2-didehydroformosanan-16-carboxylic acid |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.380 |
| Log Po/w (XLOGP3) : -0.980 |
| Log Po/w (WLOGP) : 1.020 |
| Log Po/w (MLOGP) : 1.580 |
| Log Po/w (SILICOS-IT) : 1.140 |
| Consensus Log Po/w : 1.030 |