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CHEBI:134354 - deoxyadlupulone

ChEBI IDCHEBI:134354
ChEBI Namedeoxyadlupulone
Stars
DefinitionA 2-acyl-4,6-diprenylphloroglucinol in which the acyl group is specified as 2-methylbutanoyl.
Last Modified19 April 2017
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC21H30O4
Net Charge0
Average Mass346.467
Monoisotopic Mass346.21441
SMILESCCC(C)C(=O)c1c(O)c(CC=C(C)C)c(O)c(CC=C(C)C)c1O
InChIInChI=1S/C21H30O4/c1-7-14(6)18(22)17-20(24)15(10-8-12(2)3)19(23)16(21(17)25)11-9-13(4)5/h8-9,14,23-25H,7,10-11H2,1-6H3
InChIKeyVXESUOYBWMDWCJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
deoxyadlupulone (CHEBI:134354) is a 2-acyl-4,6-diprenylphloroglucinol (CHEBI:136850)
IUPAC Name 
2-methyl-1-[2,4,6-trihydroxy-3,5-bis(3-methylbut-2-en-1-yl)phenyl]butan-1-one
Synonyms  Source
3,5-diprenylphlormethylbutanophenoneChEBI
diprenylphlormethylbutanophenoneChEBI
3,5-diprenylphlormethylbutyrophenoneChEBI
diprenylphlormethylbutyrophenoneChEBI
UniProt Name  Source
deoxyadlupuloneUniProt
Manual XrefsDatabases
CPD-19789MetaCyc
Registry NumbersSources
Reaxys:2061213Reaxys