EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:230749 - 2-Hydroxypropyl octanoate

ChEBI IDCHEBI:230749
ChEBI Name2-Hydroxypropyl octanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H22O3
Net Charge0
Average Mass202.294
Monoisotopic Mass202.15689
SMILESCCCCCCCC(=O)OCC(C)O
InChIInChI=1S/C11H22O3/c1-3-4-5-6-7-8-11(13)14-9-10(2)12/h10,12H,3-9H2,1-2H3
InChIKeyGHHURQMJLARIDK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
2-Hydroxypropyl octanoate (CHEBI:230749) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
2-hydroxypropyl octanoate
Manual XrefsDatabases
98275ChemSpider
HMDB0245164HMDB