| Phytochemical Name : garcinone B |
| PCNDIDG0035 |
| Pubchem CID : 5495928 |
| Molecular formula: C23H22O6 |
| Canonical SMILES : CC(=CCC1=C(C2=C(C=C1O)OC3=C(C2=O)C4=C(C(=C3)O)OC(C=C4)(C)C)O)C |
Synonymes : garcinone B|5,9,11-trihydroxy-3,3-dimethyl-10-(3-methylbut-2-enyl)pyrano[3,2-a]xanthen-12-one|76996-28-6|CHEMBL560332|SCHEMBL17056912|CHEBI:171874|DTXSID801318177|5,9,11-Trihydroxy-3,3-dimethyl-10-(3-methyl-2-butenyl)pyrano[3,2-a]xanthen-12(3H)-one, 9CI|6,8,12-trihydroxy-2,2-dimethyl-7-(3-methylbut-2-en-1-yl)-2,5-dihydro-1,10-dioxatetraphen-5-one|Pyrano[3,2-a]xanthen-12(3H)-one, 5,9,11-trihydroxy-3,3-dimethyl-10-(3-methyl-2-butenyl)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.760 |
| Log Po/w (XLOGP3) : 5.300 |
| Log Po/w (WLOGP) : 4.650 |
| Log Po/w (MLOGP) : 1.980 |
| Log Po/w (SILICOS-IT) : 4.620 |
| Consensus Log Po/w : 4.060 |