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CHEBI:81337 - cirsimaritin

ChEBI IDCHEBI:81337
ChEBI Namecirsimaritin
Stars
DefinitionA dimethoxyflavone that is flavone substituted by methoxy groups at positions 6 and 7 and hydroxy groups at positions 5 and 4' respectively.
Last Modified14 July 2022
DownloadsMolfile
FormulaC17H14O6
Net Charge0
Average Mass314.293
Monoisotopic Mass314.07904
SMILESCOc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1OC
InChIInChI=1S/C17H14O6/c1-21-14-8-13-15(16(20)17(14)22-2)11(19)7-12(23-13)9-3-5-10(18)6-4-9/h3-8,18,20H,1-2H3
InChIKeyZIIAJIWLQUVGHB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Lithocarpus dealbatus (ncbitaxon:167400) branch (BTO:0000148) PubMed (25903150)
ChEBI Ontology
Outgoing Relation(s)
cirsimaritin (CHEBI:81337) has functional parent flavone (CHEBI:42491)
cirsimaritin (CHEBI:81337) is a dihydroxyflavone (CHEBI:38686)
cirsimaritin (CHEBI:81337) is a dimethoxyflavone (CHEBI:23798)
IUPAC Name 
5-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-4H-1-benzopyran-4-one
Synonyms  Source
ScrophuleinKEGG COMPOUND
7-MethylcapillarisinKEGG COMPOUND
4',5-dihydroxy-6,7-dimethoxyflavoneChEBI
UniProt Name  Source
cirsimaritinUniProt
Manual XrefsDatabases
C17785KEGG COMPOUND
LMPK12111163LIPID MAPS
Registry NumbersSources
Reaxys:1296636Reaxys
CAS:6601-62-3KEGG COMPOUND
CAS:6601-62-3ChemIDplus
Citations