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CHEBI:169713 - Butyl undecylenate

ChEBI IDCHEBI:169713
ChEBI NameButyl undecylenate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H28O2
Net Charge0
Average Mass240.387
Monoisotopic Mass240.20893
SMILESC=CCCCCCCCCC(=O)OCCCC
InChIInChI=1S/C15H28O2/c1-3-5-7-8-9-10-11-12-13-15(16)17-14-6-4-2/h3H,1,4-14H2,2H3
InChIKeyGRAORJFMGCQWRN-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)
Butyl undecylenate (CHEBI:169713) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
butyl undec-10-enoate
Manual XrefsDatabases
54986ChemSpider
HMDB0036426HMDB
LMFA07010797LIPID MAPS
Registry NumbersSources
CAS:109-42-2ChemIDplus