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CHEBI:25863 - pelargonidin

Default Structure
ChEBI IDCHEBI:25863
ChEBI Namepelargonidin
Stars
DefinitionAn anthocyanidin cation that is flavylium substituted by a hydroxy groups at positions 3, 5, 7 and 4'.
Last Modified7 November 2019
DownloadsMolfile
FormulaC15H11O5
Net Charge+1
Average Mass271.248
Monoisotopic Mass271.06010
SMILESOc1ccc(-c2[o+]c3cc(O)cc(O)c3cc2O)cc1
InChIInChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-7H,(H3-,16,17,18,19)/p+1
InChIKeyXVFMGWDSJLBXDZ-UHFFFAOYSA-O
Wikipedia
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
pelargonidin (CHEBI:25863) has role plant metabolite (CHEBI:76924)
pelargonidin (CHEBI:25863) is a 5-hydroxyanthocyanidin (CHEBI:140277)
pelargonidin (CHEBI:25863) is conjugate acid of pelargonidin(1−) (CHEBI:144777)
Incoming Relation(s)
4'''-demalonylsalvianin (CHEBI:31121) has functional parent pelargonidin (CHEBI:25863)
monardaein (CHEBI:6972) has functional parent pelargonidin (CHEBI:25863)
pelargonidin 3-O-(6-O-caffeoyl-β-D-glucoside) 5-O-β-D-glucoside (CHEBI:31966) has functional parent pelargonidin (CHEBI:25863)
pelargonidin 3-O-(6-O-malonyl-β-D-glucoside) (CHEBI:31965) has functional parent pelargonidin (CHEBI:25863)
pelargonidin 3-O-sophoroside (CHEBI:134007) has functional parent pelargonidin (CHEBI:25863)
pelargonidin 3-O-β-D-glucoside (CHEBI:31967) has functional parent pelargonidin (CHEBI:25863)
pelargonidin 3-O-β-D-sambubioside (CHEBI:74809) has functional parent pelargonidin (CHEBI:25863)
pelargonin (CHEBI:133365) has functional parent pelargonidin (CHEBI:25863)
salvianin (CHEBI:32115) has functional parent pelargonidin (CHEBI:25863)
pelargonidin chloride (CHEBI:28510) has part pelargonidin (CHEBI:25863)
pelargonidin(1−) (CHEBI:144777) is conjugate base of pelargonidin (CHEBI:25863)
IUPAC Name 
3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromenylium
Synonyms  Source
3,5,7-trihydroxy-2-(4-hydroxyphenyl)-1-benzopyryliumChemIDplus
pelargonidinChemIDplus
Manual XrefsDatabases
C00007232KNApSAcK
C05904KEGG COMPOUND
LMPK12010003LIPID MAPS
PelargonidinWikipedia
Registry NumbersSources
Reaxys:1688614Reaxys
CAS:134-04-3KEGG COMPOUND
CAS:7690-51-9ChemIDplus
Citations