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CHEBI:75162 - eupatin

ChEBI IDCHEBI:75162
ChEBI Nameeupatin
Stars
DefinitionA trimethoxyflavone that is quercetagetin methylated at positions 4', 6 and 7.
Last Modified28 August 2013
DownloadsMolfile
FormulaC18H16O8
Net Charge0
Average Mass360.318
Monoisotopic Mass360.08452
SMILESCOc1ccc(-c2oc3cc(OC)c(OC)c(O)c3c(=O)c2O)cc1O
InChIInChI=1S/C18H16O8/c1-23-10-5-4-8(6-9(10)19)17-16(22)14(20)13-11(26-17)7-12(24-2)18(25-3)15(13)21/h4-7,19,21-22H,1-3H3
InChIKeyZZEQOHMDRQUMMH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
eupatin (CHEBI:75162) has functional parent quercetagetin (CHEBI:8695)
eupatin (CHEBI:75162) is a flavonols (CHEBI:28802)
eupatin (CHEBI:75162) is a trihydroxyflavone (CHEBI:27116)
eupatin (CHEBI:75162) is a trimethoxyflavone (CHEBI:27124)
IUPAC Name 
3,5-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxy-4H-chromen-4-one
Synonym  Source
3,3',5-trihydroxy-4',6,7-trimethoxyflavoneChEBI
Manual XrefsDatabases
LMPK12113003LIPID MAPS
Registry NumbersSources
Reaxys:1441245Reaxys
CAS:19587-65-6ChemIDplus