CHEBI:182695 - DL-alpha-Tocopherol acetate

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ChEBI Name DL-alpha-Tocopherol acetate
ChEBI ID CHEBI:182695
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C31H52O3
Net Charge 0
Average Mass 472.754
Monoisotopic Mass 472.39165
InChI InChI=1S/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3
InChIKey ZAKOWWREFLAJOT-UHFFFAOYSA-N
SMILES O1C(CCCC(CCCC(CCCC(C)C)C)C)(CCC2=C1C(=C(C(OC(=O)C)=C2C)C)C)C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in small intestine (BTO:0000651). of strain C57BL/6 Mouse [THESAURUS.OWL#C14424] See: MetaboLights Study
Nippostrongylus brasiliensis (NCBI:txid27835) Found in Whole Organism (THESAURUS.OWL#C13413). See: MetaboLights Study
Roles Classification
Chemical Role(s): antioxidant
A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
(via tocol )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing DL-alpha-Tocopherol acetate (CHEBI:182695) is a tocol (CHEBI:39437)
IUPAC Name
[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] acetate
Manual Xrefs Databases
2033 ChemSpider
D01735 KEGG DRUG
HMDB0034227 HMDB
View more database links
Registry Number Type Source
52225-20-4 CAS Registry Number ChemIDplus