CHEBI:46430 - (S,S,S)-α-tocopherol

ChEBI IDCHEBI:46430
ChEBI Name(S,S,S)-α-tocopherol
Stars
ASCII Name(S,S,S)-alpha-tocopherol
DefinitionThe (S,S,S)-stereoisomer of α-tocopherol.
Last Modified4 August 2021
DownloadsMolfile
FormulaC29H50O2
Net Charge0
Average Mass430.717
Monoisotopic Mass430.38108
SMILESCc1c(C)c2c(c(C)c1O)CC[C@](C)(CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C)O2
InChIInChI=1S/C29H50O2/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/h20-22,30H,9-19H2,1-8H3/t21-,22-,29-/m0/s1
InChIKeyGVJHHUAWPYXKBD-SYZUXVNWSA-N
Roles Classification
Chemical Roles:
food antioxidant  An antioxidant that used as a food additives to help guard against food deterioration.
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
food antioxidant  An antioxidant that used as a food additives to help guard against food deterioration.
fat-soluble vitamin (role)  Any vitamin that dissolves in fats and are stored in body tissues. Unlike the water-soluble vitamins, they are stored in the body for long periods of time and generally pose a greater risk for toxicity when consumed in excess.
fat-soluble vitamin (role)  Any vitamin that dissolves in fats and are stored in body tissues. Unlike the water-soluble vitamins, they are stored in the body for long periods of time and generally pose a greater risk for toxicity when consumed in excess.
Application:
food antioxidant  An antioxidant that used as a food additives to help guard against food deterioration.
ChEBI Ontology
Outgoing Relation(s)
(S,S,S)-α-tocopherol (CHEBI:46430) is a α-tocopherol (CHEBI:22470)
(S,S,S)-α-tocopherol (CHEBI:46430) is enantiomer of (R,R,R)-α-tocopherol (CHEBI:18145)
Incoming Relation(s)
(R,R,R)-α-tocopherol (CHEBI:18145) is enantiomer of (S,S,S)-α-tocopherol (CHEBI:46430)
IUPAC Name 
(2S)-2,5,7,8-tetramethyl-2-[(4S,8S)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol
Synonyms  Source
(2S,4'S,8'S)-α-tocopherolChEBI
(2S)-2,5,7,8-tetramethyl-2-[(4S,8S)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-1-benzopyran-6-olIUPAC
(−)-α-tocopherolChEBI
(2S,4'S,8'S)-alpha-tocopherolChEBI
SSS-α-tocopherolChEBI
(all-S)-α-tocopherolChEBI
Manual XrefsDatabases
VITPDBeChem
DB00163DrugBank
1379386ChemSpider
Registry NumbersSources
Reaxys:6574814Reaxys
CAS:77171-97-2ChEBI
Citations