EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:134087 - 3-hydroxyanthocyanidin betaine

ChEBI IDCHEBI:134087
ChEBI Name3-hydroxyanthocyanidin betaine
Stars
DefinitionAn oxonium betaine obtained by deprotonation of the 3-hydroxy group of any 3-hydroxyanthocyanidin cation. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified21 March 2017
SubmitterAnne Morgat
DownloadsMolfile
FormulaC15O2R10
Net Charge0
Average Mass (excl. R groups)212.160
Monoisotopic Mass (excl. R groups)211.98983
SMILES*c1c(*)c(*)c(-c2[o+]c3c(*)c(*)c(*)c(*)c3c(*)c2[O-])c(*)c1*
ChEBI Ontology
Outgoing Relation(s)
3-hydroxyanthocyanidin betaine (CHEBI:134087) is a flavonoid (CHEBI:47916)
3-hydroxyanthocyanidin betaine (CHEBI:134087) is a oxonium betaine (CHEBI:51978)
3-hydroxyanthocyanidin betaine (CHEBI:134087) is conjugate base of 3-hydroxyanthocyanidin cation (CHEBI:134085)
Incoming Relation(s)
4-unsubstituted 3-hydroxyanthocyanidin betaine (CHEBI:138177) is a 3-hydroxyanthocyanidin betaine (CHEBI:134087)
3-hydroxyanthocyanidin cation (CHEBI:134085) is conjugate acid of 3-hydroxyanthocyanidin betaine (CHEBI:134087)
UniProt Name  Source
an anthocyanidin with a 3-hydroxy groupUniProt
Citations