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CHEBI:65771 - 6'',7''-dihydro-5',5'''-dicapsaicin

ChEBI IDCHEBI:65771
ChEBI Name6'',7''-dihydro-5',5'''-dicapsaicin
Stars
DefinitionA capsaicinoid that is a dimer obtained by replacement of the hydrogen at position 5' of capsaicin with 6'',7''-dihydrocapsaicin. It is isolated from the dried fruits of Capsicum annuum and exhibits antioxidant activity.
Last Modified7 April 2017
DownloadsMolfile
FormulaC36H54N2O6
Net Charge0
Average Mass610.836
Monoisotopic Mass610.39819
SMILESCOc1cc(CNC(=O)CCCC/C=C/C(C)C)cc(-c2cc(CNC(=O)CCCCCCC(C)C)cc(OC)c2O)c1O
InChIInChI=1S/C36H54N2O6/c1-25(2)15-11-7-9-13-17-33(39)37-23-27-19-29(35(41)31(21-27)43-5)30-20-28(22-32(44-6)36(30)42)24-38-34(40)18-14-10-8-12-16-26(3)4/h11,15,19-22,25-26,41-42H,7-10,12-14,16-18,23-24H2,1-6H3,(H,37,39)(H,38,40)/b15-11+
InChIKeyVONRPUZNFPTEEM-RVDMUPIBSA-N
Species of MetaboliteComponentSourceComments
Capsicum annuum (ncbitaxon:4072) fruit (BTO:0000486) PubMed (12932131) Dried fruit
Roles Classification
Chemical Role:
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.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
6'',7''-dihydro-5',5'''-dicapsaicin (CHEBI:65771) has role antioxidant (CHEBI:22586)
6'',7''-dihydro-5',5'''-dicapsaicin (CHEBI:65771) has role plant metabolite (CHEBI:76924)
6'',7''-dihydro-5',5'''-dicapsaicin (CHEBI:65771) is a biphenyls (CHEBI:22888)
6'',7''-dihydro-5',5'''-dicapsaicin (CHEBI:65771) is a capsaicinoid (CHEBI:46931)
6'',7''-dihydro-5',5'''-dicapsaicin (CHEBI:65771) is a guaiacols (CHEBI:134251)
6'',7''-dihydro-5',5'''-dicapsaicin (CHEBI:65771) is a monocarboxylic acid amide (CHEBI:29347)
IUPAC Name 
(6E)-N-[(2',6-dihydroxy-3',5-dimethoxy-5'-{[(8-methylnonanoyl)amino]methyl}biphenyl-3-yl)methyl]-8-methylnon-6-enamide
Manual XrefsDatabases
8659280ChemSpider
Registry NumbersSources
Reaxys:9536502Reaxys
Citations