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CHEBI:181477 - 5-(6-Methyl-6-hydroxyheptyl)furan-2(5H)-one

ChEBI IDCHEBI:181477
ChEBI Name5-(6-Methyl-6-hydroxyheptyl)furan-2(5H)-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H20O3
Net Charge0
Average Mass212.289
Monoisotopic Mass212.14124
SMILESCC(C)(O)CCCCCC1C=CC(=O)O1
InChIInChI=1S/C12H20O3/c1-12(2,14)9-5-3-4-6-10-7-8-11(13)15-10/h7-8,10,14H,3-6,9H2,1-2H3
InChIKeyRFEPDQFPTNCOBK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-(6-Methyl-6-hydroxyheptyl)furan-2(5H)-one (CHEBI:181477) is a butenolide (CHEBI:50523)
IUPAC Name 
2-(6-hydroxy-6-methylheptyl)-2H-uran-5-one
Manual XrefsDatabases
9217240ChemSpider