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CHEBI:210759 - Pestalone E

ChEBI IDCHEBI:210759
ChEBI NamePestalone E
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SubmitterMetaboLights
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FormulaC20H19ClO6
Net Charge0
Average Mass390.819
Monoisotopic Mass390.08702
SMILESCC(C)=CCc1c(O)cc(O)c(C=O)c1C(=O)c1c(O)cc(C)c(Cl)c1O
InChIInChI=1S/C20H19ClO6/c1-9(2)4-5-11-13(23)7-14(24)12(8-22)16(11)19(26)17-15(25)6-10(3)18(21)20(17)27/h4,6-8,23-25,27H,5H2,1-3H3
InChIKeyRYCFVSWWKSWKTH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis neglecta (ncbitaxon:173184) - PubMed (31829592)
ChEBI Ontology
Outgoing Relation(s)
Pestalone E (CHEBI:210759) is a benzophenones (CHEBI:22726)
IUPAC Name 
2-(3-chloro-2,6-dihydroxy-4-methylbenzoyl)-4,6-dihydroxy-3-(3-methylbut-2-enyl)benzaldehyde
Manual XrefsDatabases
81361122ChemSpider