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CHEBI:193453 - 6-[2-(2H-1,3-benzodioxol-5-yl)-2-hydroxyethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one

ChEBI IDCHEBI:193453
ChEBI Name6-[2-(2H-1,3-benzodioxol-5-yl)-2-hydroxyethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O6
Net Charge0
Average Mass292.287
Monoisotopic Mass292.09469
SMILESCOC1=CC(=O)OC(CC(O)c2ccc3c(c2)OCO3)C1
InChIInChI=1S/C15H16O6/c1-18-10-5-11(21-15(17)7-10)6-12(16)9-2-3-13-14(4-9)20-8-19-13/h2-4,7,11-12,16H,5-6,8H2,1H3
InChIKeyPBDMLDUYCREDBG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
6-[2-(2H-1,3-benzodioxol-5-yl)-2-hydroxyethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one (CHEBI:193453) is a 2-pyranones (CHEBI:75885)
6-[2-(2H-1,3-benzodioxol-5-yl)-2-hydroxyethyl]-4-methoxy-5,6-dihydro-2H-pyran-2-one (CHEBI:193453) is a aromatic ether (CHEBI:35618)
IUPAC Name 
2-[2-(1,3-benzodioxol-5-yl)-2-hydroxyethyl]-4-methoxy-2,3-dihydropyran-6-one
Manual XrefsDatabases
74852930ChemSpider