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CHEBI:174212 - Apional

Default Structure
ChEBI IDCHEBI:174212
ChEBI NameApional
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12O5
Net Charge0
Average Mass236.223
Monoisotopic Mass236.06847
SMILESCOc1cc(/C=C/C=O)c(OC)c2c1OCO2
InChIInChI=1S/C12H12O5/c1-14-9-6-8(4-3-5-13)10(15-2)12-11(9)16-7-17-12/h3-6H,7H2,1-2H3/b4-3+
InChIKeyWTHYSOXPCHPBOG-ONEGZZNKSA-N
ChEBI Ontology
Outgoing Relation(s)
Apional (CHEBI:174212) is a benzodioxoles (CHEBI:38298)
IUPAC Name 
(E)-3-(4,7-dimethoxy-1,3-benzodioxol-5-yl)prop-2-enal
Manual XrefsDatabases
8118382ChemSpider
HMDB0033096HMDB