| Phytochemical Name : Malabaricone C |
| PCNDIDM0014 |
| Pubchem CID : 100313 |
| Molecular formula: C21H26O5 |
| Canonical SMILES : C1=CC(=C(C(=C1)O)C(=O)CCCCCCCCC2=CC(=C(C=C2)O)O)O |
Synonymes : Malabaricone C|63335-25-1|1-(2,6-dihydroxyphenyl)-9-(3,4-dihydroxyphenyl)nonan-1-one|CHEBI:69015|C9K53R3PRN|NSC-287968|1-(2,6-dihydroxyphenyl)-9-(3,4-dihydroxyphenyl)-1-nonanone|1-Nonanone, 1-(2,6-dihydroxyphenyl)-9-(3,4-dihydroxyphenyl)-|UNII-C9K53R3PRN|CHEMBL524100|MEGxp0_000379|SCHEMBL7784918|DTXSID40212721|HY-N8518|BDBM50182491|NSC287968|AKOS040763675|NSC 287968|MS-25640|XM175848|CS-0145503|E88916|Q27137360|Carbamimidothioic acid, 2-methoxyethyl ester, monohydrobromide|1-(2,6-Bis(oxidanyl)phenyl)-9-(3,4-bis(oxidanyl)phenyl)nonan-1-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.250 |
| Log Po/w (XLOGP3) : 5.690 |
| Log Po/w (WLOGP) : 4.670 |
| Log Po/w (MLOGP) : 2.510 |
| Log Po/w (SILICOS-IT) : 4.540 |
| Consensus Log Po/w : 3.930 |