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CHEBI:61682 - ubiquinol-8

ChEBI IDCHEBI:61682
ChEBI Nameubiquinol-8
Stars
DefinitionA ubiquinol in which the polyprenyl substituent is octaprenyl.
Last Modified23 October 2015
SubmitterEugeni Belda
DownloadsMolfile
FormulaC49H76O4
Net Charge0
Average Mass729.143
Monoisotopic Mass728.57436
SMILESCOc1c(O)c(C)c(C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)c(O)c1OC
InChIInChI=1S/C49H76O4/c1-36(2)20-13-21-37(3)22-14-23-38(4)24-15-25-39(5)26-16-27-40(6)28-17-29-41(7)30-18-31-42(8)32-19-33-43(9)34-35-45-44(10)46(50)48(52-11)49(53-12)47(45)51/h20,22,24,26,28,30,32,34,50-51H,13-19,21,23,25,27,29,31,33,35H2,1-12H3/b37-22+,38-24+,39-26+,40-28+,41-30+,42-32+,43-34+
InChIKeyLOJUQFSPYHMHEO-SGHXUWJISA-N
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
ubiquinol-8 (CHEBI:61682) has role antineoplastic agent (CHEBI:35610)
ubiquinol-8 (CHEBI:61682) is a polyprenylhydroquinone (CHEBI:26253)
ubiquinol-8 (CHEBI:61682) is a ubiquinol (CHEBI:17976)
IUPAC Name 
2,3-dimethoxy-5-methyl-6-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl]benzene-1,4-diol
Synonyms  Source
ubiquinol(8)ChEBI
reduced coenzyme Q8ChEBI
UniProt Name  Source
ubiquinol-8UniProt
Manual XrefsDatabases
CPD-9956MetaCyc
Registry NumbersSources
Reaxys:14244780Reaxys