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CHEBI:166698 - d-Tocotrienol

Default Structure
ChEBI IDCHEBI:166698
ChEBI Named-Tocotrienol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H40O2
Net Charge0
Average Mass396.615
Monoisotopic Mass396.30283
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CCC1(C)CCc2cc(O)cc(C)c2O1
InChIInChI=1S/C27H40O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h10,12,14,18-19,28H,7-9,11,13,15-17H2,1-6H3/b21-12+,22-14+
InChIKeyODADKLYLWWCHNB-QRCIITMISA-N
Roles Classification
Chemical Role:
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
ChEBI Ontology
Outgoing Relation(s)
d-Tocotrienol (CHEBI:166698) is a tocotrienol (CHEBI:33235)
IUPAC Name 
2,8-dimethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-3,4-dihydrochromen-6-ol
Manual XrefsDatabases
5256774ChemSpider
HMDB0030008HMDB