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CHEBI:8306 - Polygonolide

ChEBI IDCHEBI:8306
ChEBI NamePolygonolide
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC12H12O4
Net Charge0
Average Mass220.224
Monoisotopic Mass220.07356
SMILESCOc1cc(O)c2c(=O)oc(C)c(C)c2c1
InChIInChI=1S/C12H12O4/c1-6-7(2)16-12(14)11-9(6)4-8(15-3)5-10(11)13/h4-5,13H,1-3H3
InChIKeyISJYICQTJIFNAX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Polygonolide (CHEBI:8306) is a isocoumarins (CHEBI:38758)
Synonym  Source
PolygonolideKEGG COMPOUND
Manual XrefsDatabases
C09963KEGG COMPOUND
C00003012KNApSAcK
Registry NumbersSources
CAS:100560-66-5KEGG COMPOUND