CHEBI:168839 - 2-Furanylmethyl butanoate

ChEBI IDCHEBI:168839
ChEBI Name2-Furanylmethyl butanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H12O3
Net Charge0
Average Mass168.192
Monoisotopic Mass168.07864
SMILESCCCC(=O)OCc1ccco1
InChIInChI=1S/C9H12O3/c1-2-4-9(10)12-7-8-5-3-6-11-8/h3,5-6H,2,4,7H2,1H3
InChIKeyIXISGRHWGVGCAK-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)
2-Furanylmethyl butanoate (CHEBI:168839) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
uran-2-ylmethyl butanoate
Manual XrefsDatabases
55114ChemSpider
HMDB0037729HMDB
LMFA07010714LIPID MAPS
Registry NumbersSources
CAS:623-21-2ChemIDplus