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CHEBI:9400 - tangeretin

ChEBI IDCHEBI:9400
ChEBI Nametangeretin
Stars
DefinitionA pentamethoxyflavone flavone with methoxy groups at positions 4', 5, 6 , 7 and 8.
Last Modified25 February 2016
DownloadsMolfile
FormulaC20H20O7
Net Charge0
Average Mass372.373
Monoisotopic Mass372.12090
SMILESCOc1ccc(-c2cc(=O)c3c(OC)c(OC)c(OC)c(OC)c3o2)cc1
InChIInChI=1S/C20H20O7/c1-22-12-8-6-11(7-9-12)14-10-13(21)15-16(23-2)18(24-3)20(26-5)19(25-4)17(15)27-14/h6-10H,1-5H3
InChIKeyULSUXBXHSYSGDT-UHFFFAOYSA-N
Wikipedia
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.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
tangeretin (CHEBI:9400) has role antineoplastic agent (CHEBI:35610)
tangeretin (CHEBI:9400) has role plant metabolite (CHEBI:76924)
tangeretin (CHEBI:9400) is a pentamethoxyflavone (CHEBI:38724)
Incoming Relation(s)
gardenin B (CHEBI:79628) has functional parent tangeretin (CHEBI:9400)
IUPAC Name 
5,6,7,8-tetramethoxy-2-(4-methoxyphenyl)-4H-chromen-4-one
Synonyms  Source
TangeretinKEGG COMPOUND
5,6,7,8,4'-PentamethoxyflavoneKEGG COMPOUND
4',5,6,7,8-pentamethoxyflavoneChemIDplus
tangeritinChEBI
5,6,7,8-tetramethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-oneChEBI
Manual XrefsDatabases
C10190KEGG COMPOUND
LMPK12111443LIPID MAPS
TangeritinWikipedia
HMDB0030539HMDB
CN102344429Patent
CN101947215Patent
C00001105KNApSAcK
LSM-2548LINCS
Registry NumbersSources
Reaxys:351695Reaxys
CAS:481-53-8KEGG COMPOUND
CAS:481-53-8ChemIDplus
Citations