CHEBI:172098 - Heptyl octanoate

ChEBI IDCHEBI:172098
ChEBI NameHeptyl octanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H30O2
Net Charge0
Average Mass242.403
Monoisotopic Mass242.22458
SMILESCCCCCCCOC(=O)CCCCCCC
InChIInChI=1S/C15H30O2/c1-3-5-7-9-11-13-15(16)17-14-12-10-8-6-4-2/h3-14H2,1-2H3
InChIKeyTZXWLJYLYILFGM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
Heptyl octanoate (CHEBI:172098) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
heptyl octanoate
Manual XrefsDatabases
55278ChemSpider
HMDB0036218HMDB
LMFA07010903LIPID MAPS
Registry NumbersSources
CAS:4265-97-8ChemIDplus