| Phytochemical Name : delta-Tocotrienol |
| PCNDIDD0060 |
| Pubchem CID : 5282350 |
| Molecular formula: C27H40O2 |
| Canonical SMILES : CC1=CC(=CC2=C1OC(CC2)(C)CCC=C(C)CCC=C(C)CCC=C(C)C)O |
Synonymes : delta-Tocotrienol|25612-59-3|Tocotrienol, delta|8-Methyltocotrienol|.delta.-Tocotrienol|(R)-delta-Tocotrienol|UNII-1SRB74OWSI|1SRB74OWSI|(R)-.delta.-Tocotrienol|D-DELTA-TOCOTRIENOL|(2R)-2,8-dimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-3,4-dihydrochromen-6-ol|CHEBI:33276|(R)-2,8-Dimethyl-2-((3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl)chroman-6-ol|2H-1-Benzopyran-6-ol, 3,4-dihydro-2,8-dimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-, (R-(E,E))-|2H-1-Benzopyran-6-ol, 3,4-dihydro-2,8-dimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-, [R-(E,E)]-|2H-1-benzopyran-6-ol, 3,4-dihydro-2,8-dimethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrienyl]-, (2R)-|2R,8-dimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-chromen-6-ol|Delta-tocotrienols|delta -Tocotrienol|2H-1-BENZOPYRAN-6-OL, 3,4-DIHYDRO-2,8-DIMETHYL-2-((3E,7E)-4,8,12-TRIMETHYL-3,7,11-TRIDECATRIEN-1-YL)-, (2R)-|2H-1-BENZOPYRAN-6-OL, 3,4-DIHYDRO-2,8-DIMETHYL-2-((3E,7E)-4,8,12-TRIMETHYL-3,7,11-TRIDECATRIENYL)-, (2R)-|2H-1-Benzopyran-6-ol, 3,4-dihydro-2,8-dimethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrien-1-yl]-, (2R)-|R-delta-tocotrienol|BIDD:PXR0041|CHEMBL121305|SCHEMBL8408117|SCHEMBL16430161|DTXSID30180288|HMS3650C18|DELTA TOCOTRIENOL [WHO-DD]|LMPR02020056|delta-Tocotrienol, analytical standard|AKOS040760094|NCGC00253541-03|AS-82630|J17.358D|HY-122778|CS-0089253|SR-01000946270|SR-01000946270-1|Q27104272|2,8-Dimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-6-chromanol|6-Chromanol, 2,8-dimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-|6-Chromanol, 2,8-dimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)- (7CI,8CI)|(2R)-2,8-dimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-chromen-6-ol|(R-(E,E))-3,4-Dihydro-2,8-dimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-2H-1-benzopyran-6-ol|2H-1-Benzopyran-6-ol, 3,4-dihydro-2,8-dimethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrienyl]-, (2R)- (9CI)|3,4-Dihydro-2,8-dimethyl-2-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-2H-1-benzopyran-6-ol, 9CI |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.050 |
| Log Po/w (XLOGP3) : 3.480 |
| Log Po/w (WLOGP) : 3.050 |
| Log Po/w (MLOGP) : 2.870 |
| Log Po/w (SILICOS-IT) : 3.070 |
| Consensus Log Po/w : 2.900 |