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CHEBI:79628 - gardenin B

Default Structure
ChEBI IDCHEBI:79628
ChEBI Namegardenin B
Stars
DefinitionA tetramethoxyflavone that is tangeretin in which the methoxy group at position 5 has been replaced by a hydroxy group.
Last Modified14 July 2022
DownloadsMolfile
FormulaC19H18O7
Net Charge0
Average Mass358.346
Monoisotopic Mass358.10525
SMILESCOc1ccc(-c2cc(=O)c3c(O)c(OC)c(OC)c(OC)c3o2)cc1
InChIInChI=1S/C19H18O7/c1-22-11-7-5-10(6-8-11)13-9-12(20)14-15(21)17(23-2)19(25-4)18(24-3)16(14)26-13/h5-9,21H,1-4H3
InChIKeyLXEVSYZNYDZSOB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Biebersteinia orphanidis (ncbitaxon:74351) - PubMed (11198823)
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)
gardenin B (CHEBI:79628) has functional parent tangeretin (CHEBI:9400)
gardenin B (CHEBI:79628) has role plant metabolite (CHEBI:76924)
gardenin B (CHEBI:79628) is a monohydroxyflavone (CHEBI:38687)
gardenin B (CHEBI:79628) is a tetramethoxyflavone (CHEBI:76875)
IUPAC Name 
5-hydroxy-6,7,8-trimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
Synonyms  Source
5-Hydroxy-2-(4-methoxyphenyl)-6,7,8-trimethoxy-4H-1-benzopyran-4-oneKEGG COMPOUND
5-Hydroxy-4',6,7,8-tetramethoxyflavoneKEGG COMPOUND
DemethyltangeretinKEGG COMPOUND
UniProt Name  Source
gardenin BUniProt
Manual XrefsDatabases
C00003883KNApSAcK
C15109KEGG COMPOUND
LMPK12111451LIPID MAPS
Registry NumbersSources
CAS:2798-20-1KEGG COMPOUND
Citations