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CHEBI:201127 - Pestalotionol

ChEBI IDCHEBI:201127
ChEBI NamePestalotionol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O3
Net Charge0
Average Mass234.295
Monoisotopic Mass234.12559
SMILESCC(=O)c1c(C)cc(O)c(CC=C(C)C)c1O
InChIInChI=1S/C14H18O3/c1-8(2)5-6-11-12(16)7-9(3)13(10(4)15)14(11)17/h5,7,16-17H,6H2,1-4H3
InChIKeyLZVUKJJVOUNEDB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis (ncbitaxon:37840) - DOI (10.1016/j.tet.2014.12.009)
ChEBI Ontology
Outgoing Relation(s)
Pestalotionol (CHEBI:201127) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
1-[2,4-dihydroxy-6-methyl-3-(3-methylbut-2-enyl)phenyl]ethanone
Manual XrefsDatabases
35516796ChemSpider