EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:171773 - 3,4-Epoxynonanal

ChEBI IDCHEBI:171773
ChEBI Name3,4-Epoxynonanal
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H16O2
Net Charge0
Average Mass156.225
Monoisotopic Mass156.11503
SMILESCCCCCC1OC1CC=O
InChIInChI=1S/C9H16O2/c1-2-3-4-5-8-9(11-8)6-7-10/h7-9H,2-6H2,1H3
InChIKeyHEXGZHJMMROIQO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
3,4-Epoxynonanal (CHEBI:171773) is a aldehyde (CHEBI:17478)
IUPAC Name 
2-(3-pentyloxiran-2-yl)acetaldehyde
Manual XrefsDatabases
HMDB0060286HMDB
21233729ChemSpider