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CHEBI:168289 - Rhubafuran

ChEBI IDCHEBI:168289
ChEBI NameRhubafuran
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O
Net Charge0
Average Mass176.259
Monoisotopic Mass176.12012
SMILESCC1CC(C)(c2ccccc2)CO1
InChIInChI=1S/C12H16O/c1-10-8-12(2,9-13-10)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChIKeyGPMLJOOQCIHFET-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Rhubafuran (CHEBI:168289) is a benzenes (CHEBI:22712)
IUPAC Name 
2,4-dimethyl-4-phenyloxolane
Manual XrefsDatabases
HMDB0036021HMDB
101722ChemSpider
Registry NumbersSources
CAS:82461-14-1ChemIDplus