| Phytochemical Name : Gomisin J |
| PCNDIDG0129 |
| Pubchem CID : 3001686 |
| Molecular formula: C22H28O6 |
| Canonical SMILES : CC1CC2=CC(=C(C(=C2C3=C(C(=C(C=C3CC1C)O)OC)OC)OC)OC)O |
Synonymes : Gomisin J|66280-25-9|(-)-Gomisin J|UNII-X13A57600T|X13A57600T|DTXSID30216490|(9S,10R)-3,4,15,16-tetramethoxy-9,10-dimethyltricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaene-5,14-diol|Gomisin-J|DIBENZO(A,C)CYCLOOCTENE-3,10-DIOL, 5,6,7,8-TETRAHYDRO-1,2,11,12-TETRAMETHOXY-6,7-DIMETHYL-, (6R,7S,12AS)-|Dibenzo(a,c)cyclooctene-3,10-diol, 5,6,7,8-tetrahydro-1,2,11,12-tetramethoxy-6,7-dimethyl-, stereoisomer|GomisinJ|CHEMBL251864|SCHEMBL1200718|C2H28O6|DTXCID30138981|C2-H28-O6|MFCD29048562|AKOS037514683|AC-34256|Q27293263|(6R,7S,12AS)-1,2,11,12-tetramethoxy-6,7-dimethyl-5,6,7,8-tetrahydrodibenzo[a,c][8]annulene-3,10-diol|6(S),7(R)-Dibenzo(a,c)cyclooctene-3,10-diol, 5,6,7,8-tetrahydro-1,2,11,12-tetramethoxy-6,7-dimethyl- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 3.570 |
| Log Po/w (XLOGP3) : 4.610 |
| Log Po/w (WLOGP) : 4.170 |
| Log Po/w (MLOGP) : 2.140 |
| Log Po/w (SILICOS-IT) : 4.060 |
| Consensus Log Po/w : 3.710 |