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CHEBI:193098 - peonidin 3-O-β-D-galactoside betaine

ChEBI IDCHEBI:193098
ChEBI Namepeonidin 3-O-β-D-galactoside betaine
Stars
ASCII Namepeonidin 3-O-beta-D-galactoside betaine
DefinitionMajor microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC22H22O11
Net Charge0
Average Mass462.407
Monoisotopic Mass462.11621
SMILESCOc1cc(-c2[o+]c3cc(O)cc([O-])c3cc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1O
InChIInChI=1S/C22H22O11/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)/t17-,18+,19+,20-,22-/m1/s1
InChIKeyZZWPMFROUHHAKY-VRRLNDPFSA-N
ChEBI Ontology
Outgoing Relation(s)
peonidin 3-O-β-D-galactoside betaine (CHEBI:193098) has functional parent peonidin(1−) (CHEBI:144779)
peonidin 3-O-β-D-galactoside betaine (CHEBI:193098) is a oxonium betaine (CHEBI:51978)
UniProt Name  Source
peonidin 3-O-β-D-galactosideUniProt
Citations