EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:8427 - probucol

ChEBI IDCHEBI:8427
ChEBI Nameprobucol
Stars
DefinitionA dithioketal that is propane-2,2-dithiol in which the hydrogens attached to both sulfur atoms are replaced by 3,5-di-tert-butyl-4-hydroxyphenyl groups. An anticholesteremic drug with antioxidant and anti-inflammatory properties, it is used to treat high levels of cholesterol in blood.
Last Modified22 February 2017
DownloadsMolfile
FormulaC31H48O2S2
Net Charge0
Average Mass516.857
Monoisotopic Mass516.30957
SMILESCC(C)(Sc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)Sc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1
InChIInChI=1S/C31H48O2S2/c1-27(2,3)21-15-19(16-22(25(21)32)28(4,5)6)34-31(13,14)35-20-17-23(29(7,8)9)26(33)24(18-20)30(10,11)12/h15-18,32-33H,1-14H3
InChIKeyFYPMFJGVHOHGLL-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Applications:
anti-inflammatory drug  A substance that reduces or suppresses inflammation.
cardiovascular drug  A drug that affects the rate or intensity of cardiac contraction, blood vessel diameter or blood volume.
anticholesteremic drug  A substance used to lower plasma cholesterol levels.
antilipemic drug  A substance used to treat hyperlipidemia (an excess of lipids in the blood).
ChEBI Ontology
Outgoing Relation(s)
probucol (CHEBI:8427) has role anti-inflammatory drug (CHEBI:35472)
probucol (CHEBI:8427) has role anticholesteremic drug (CHEBI:35821)
probucol (CHEBI:8427) has role antilipemic drug (CHEBI:35679)
probucol (CHEBI:8427) has role antioxidant (CHEBI:22586)
probucol (CHEBI:8427) has role cardiovascular drug (CHEBI:35554)
probucol (CHEBI:8427) is a dithioketal (CHEBI:59800)
probucol (CHEBI:8427) is a polyphenol (CHEBI:26195)
IUPAC Name 
4,4'-(propane-2,2-diyldisulfanediyl)bis(2,6-di-tert-butylphenol)
INNs  Source
probucolumChemIDplus
probucolWHO MedNet
probucolWHO MedNet
probucolWHO MedNet
Synonyms  Source
BiphenabidChemIDplus
BisphenabidChemIDplus
BisbidChemIDplus
4,4'- (Isopropylidenedithio)bis(2,6-di-tert-butylphenol)HMDB
Acetone bis(3,5-di-tert-butyl-4-hydroxyphenyl) mercaptoleHMDB
DH-581ChEBI
Brand Names  Source
LesterolChemIDplus
LorelcoKEGG DRUG
SerterolChEBI
LurselleChEBI
SuperlipidChEBI
Manual XrefsDatabases
C07373KEGG COMPOUND
D00476KEGG DRUG
CN101423484Patent
CN101455842Patent
CN102973535Patent
ProbucolWikipedia
HMDB0015537HMDB
DB01599DrugBank
FR1561853Patent
US3576883Patent
US3862332Patent
LSM-3617LINCS
2269DrugCentral
Registry NumbersSources
Reaxys:2026253Reaxys
CAS:23288-49-5KEGG COMPOUND
CAS:23288-49-5ChemIDplus
Citations