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CHEBI:183779 - 4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoic acid

ChEBI IDCHEBI:183779
ChEBI Name4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O4
Net Charge0
Average Mass222.240
Monoisotopic Mass222.08921
SMILESO=C(O)CCCc1ccc2c(c1)OCCO2
InChIInChI=1S/C12H14O4/c13-12(14)3-1-2-9-4-5-10-11(8-9)16-7-6-15-10/h4-5,8H,1-3,6-7H2,(H,13,14)
InChIKeyZFCRXHHGVUYVTG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bombus terrestris (ncbitaxon:30195)
hindgut (BTO:0000510) MetaboLights (MTBLS3637)
brain (BTO:0000142) MetaboLights (MTBLS3637)
hemolymph (BTO:0000572) MetaboLights (MTBLS3637)
ChEBI Ontology
Outgoing Relation(s)
4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoic acid (CHEBI:183779) is a benzodioxine (CHEBI:64096)
IUPAC Name 
4-(2,3-dihydro-1,4-benzodioxin-6-yl)butanoic acid
Manual XrefsDatabases
2056051ChemSpider