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CHEBI:75033 - peonidin chloride

ChEBI IDCHEBI:75033
ChEBI Namepeonidin chloride
Stars
DefinitionAn anthocyanidin chloride that has peonidin as the cationic component.
Secondary ChEBI IDCHEBI:7987
Last Modified22 August 2013
DownloadsMolfile
FormulaC16H13O6.Cl
Net Charge0
Average Mass336.727
Monoisotopic Mass336.04007
SMILESCOc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O)ccc1O.[Cl-]
InChIInChI=1S/C16H12O6.ClH/c1-21-15-4-8(2-3-11(15)18)16-13(20)7-10-12(19)5-9(17)6-14(10)22-16;/h2-7H,1H3,(H3-,17,18,19,20);1H
InChIKeyOGBSHLKSHNAPEW-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
apoptosis inducer  Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
peonidin chloride (CHEBI:75033) has part peonidin (CHEBI:75314)
peonidin chloride (CHEBI:75033) has role antineoplastic agent (CHEBI:35610)
peonidin chloride (CHEBI:75033) has role antioxidant (CHEBI:22586)
peonidin chloride (CHEBI:75033) has role apoptosis inducer (CHEBI:68495)
peonidin chloride (CHEBI:75033) has role metabolite (CHEBI:25212)
peonidin chloride (CHEBI:75033) is a anthocyanidin chloride (CHEBI:38696)
IUPAC Name 
3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromenium chloride
Synonyms  Source
PeonidinKEGG COMPOUND
3,5,7-Trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyrylium chlorideKEGG COMPOUND
3,4',5,7-tetrahydroxy-3'-methoxyflavylium chlorideChEBI
Manual XrefsDatabases
C08726KEGG COMPOUND
HMDB0005797HMDB
PeonidinWikipedia
Registry NumbersSources
Reaxys:3924296Reaxys
CAS:134-01-0KEGG COMPOUND
CAS:134-01-0ChemIDplus
Citations