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CHEBI:33270 - α-tocotrienol

ChEBI IDCHEBI:33270
ChEBI Nameα-tocotrienol
Stars
ASCII Namealpha-tocotrienol
DefinitionA tocotrienol that is chroman-6-ol substituted by methyl groups at positions 2, 5, 7 and 8 and a farnesyl chain at position 2. It has been found in palm oil derived from Elaeis guineensis.
Secondary ChEBI IDCHEBI:35062
Last Modified26 July 2021
SubmitterKirill Degtyarenko
DownloadsMolfile

FormulaC29H44O2
Net Charge0
Average Mass424.669
Monoisotopic Mass424.33413
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC[C@]1(C)CCc2c(C)c(O)c(C)c(C)c2O1
InChIInChI=1S/C29H44O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h12,14,16,30H,9-11,13,15,17-19H2,1-8H3/b21-14+,22-16+/t29-/m1/s1
InChIKeyRZFHLOLGZPDCHJ-XZXLULOTSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
- DOI (10.1038/nbt.2488)
blood (UBERON:0000178) PubMed (12739983)
Panax ginseng (ncbitaxon:4054) - MetaboLights (MTBLS350) From MetaboLights
Roles Classification

ChEBI Ontology
IUPAC Name 
(2R)-2,5,7,8-tetramethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-chromen-6-ol
Synonyms  Source
α-tocotrienolChemIDplus
ζ1-tocopherolChemIDplus
alpha-tocotrienolLIPID MAPS
(2R)-2,5,7,8-tetramethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-1-benzopyran-6-olIUPAC
zeta1-tocopherolLIPID MAPS
alpha-tocotrienolKEGG COMPOUND
UniProt Name  Source
α-tocotrienolUniProt
Manual XrefsDatabases
C14153KEGG COMPOUND
LMPR02020054LIPID MAPS
HMDB0006327HMDB
EP2362875Patent
WO2010051277Patent
US2010105930Patent
CPD-15836MetaCyc
Alpha-TocotrienolWikipedia
4445512ChemSpider
FDB002434FooDB
C00035044KNApSAcK
Registry NumbersSources
Beilstein:45723Beilstein
Reaxys:5484296Reaxys
CAS:1721-51-3ChemIDplus
CAS:1721-51-3KEGG COMPOUND
Citations