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CHEBI:28620 - licoisoflavone A

ChEBI IDCHEBI:28620
ChEBI Namelicoisoflavone A
Stars
DefinitionA member of the class of 7-hydroxyisoflavones that is 7-hydroxyisoflavone substituted by additional hydroxy groups at positions 5, 2' and 4' and a prenyl group at position 3'.
Secondary ChEBI IDsCHEBI:6455, CHEBI:25034
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H18O6
Net Charge0
Average Mass354.358
Monoisotopic Mass354.11034
SMILESCC(C)=CCc1c(O)ccc(-c2coc3cc(O)cc(O)c3c2=O)c1O
InChIInChI=1S/C20H18O6/c1-10(2)3-4-13-15(22)6-5-12(19(13)24)14-9-26-17-8-11(21)7-16(23)18(17)20(14)25/h3,5-9,21-24H,4H2,1-2H3
InChIKeyKCUZCRLRQVRBBV-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
licoisoflavone A (CHEBI:28620) has role metabolite (CHEBI:25212)
licoisoflavone A (CHEBI:28620) is a 7-hydroxyisoflavones (CHEBI:55465)
Incoming Relation(s)
dihydrolicoisoflavone A (CHEBI:69091) has functional parent licoisoflavone A (CHEBI:28620)
IUPAC Name 
3-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-5,7-dihydroxy-4H-chromen-4-one
Synonyms  Source
Licoisoflavone AKEGG COMPOUND
phaseoluteoneChEBI
2',4',5,7-Tetrahydroxy-3'-(3,3-dimethylallyl)isoflavoneKEGG COMPOUND
Manual XrefsDatabases
C10486KEGG COMPOUND
CPD-6643MetaCyc
LMPK12050286LIPID MAPS
HMDB0034125HMDB
C00002542KNApSAcK
Registry NumbersSources
Reaxys:1663610Reaxys
CAS:66056-19-7KEGG COMPOUND
Citations