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CHEBI:5326 - geraldone

ChEBI IDCHEBI:5326
ChEBI Namegeraldone
Stars
DefinitionA dihydroxyflavone that is the 5-deoxy-derivative of 4',5,7-trihydroxy-3'-methoxyflavone (chrysoeriol).
Last Modified4 June 2015
DownloadsMolfile
FormulaC16H12O5
Net Charge0
Average Mass284.267
Monoisotopic Mass284.06847
SMILESCOc1cc(-c2cc(=O)c3ccc(O)cc3o2)ccc1O
InChIInChI=1S/C16H12O5/c1-20-16-6-9(2-5-12(16)18)14-8-13(19)11-4-3-10(17)7-15(11)21-14/h2-8,17-18H,1H3
InChIKeyOUMMPAFEQHTYIZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Albizia julibrissin (ncbitaxon:3813) bark (BTO:0001301) PubMed (15283458)
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)
geraldone (CHEBI:5326) has functional parent 4',5,7-trihydroxy-3'-methoxyflavone (CHEBI:16514)
geraldone (CHEBI:5326) has role plant metabolite (CHEBI:76924)
geraldone (CHEBI:5326) is a dihydroxyflavone (CHEBI:38686)
geraldone (CHEBI:5326) is a monomethoxyflavone (CHEBI:25401)
IUPAC Name 
7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one
Synonyms  Source
5-DeoxychrysoeriolKEGG COMPOUND
7,4'-dihydroxy-3'-methoxyflavoneChEBI
Manual XrefsDatabases
C10047KEGG COMPOUND
C00003826KNApSAcK
LMPK12110043LIPID MAPS
Registry NumbersSources
Reaxys:1256759Reaxys
CAS:21583-32-4KEGG COMPOUND
Citations