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CHEBI:184557 - Prenyl benzoate

ChEBI IDCHEBI:184557
ChEBI NamePrenyl benzoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O2
Net Charge0
Average Mass190.242
Monoisotopic Mass190.09938
SMILESCC(C)=CCOC(=O)c1ccccc1
InChIInChI=1S/C12H14O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3
InChIKeyINVWRXWYYVMFQC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Prenyl benzoate (CHEBI:184557) is a benzoate ester (CHEBI:36054)
IUPAC Name 
3-methylbut-2-enyl benzoate
Manual XrefsDatabases
C03885KEGG COMPOUND
HMDB0032488HMDB
NONAPRENYL-4-HYDROXYBENZOATEMetaCyc
19991ChemSpider
Registry NumbersSources
CAS:5205-11-8ChemIDplus