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CHEBI:89712 - 3-Octen-2-one

ChEBI IDCHEBI:89712
ChEBI Name3-Octen-2-one
Stars
DownloadsMolfile
FormulaC8H14O
Net Charge0
Average Mass126.199
Monoisotopic Mass126.10447
SMILESCCCC/C=C/C(C)=O
InChIInChI=1S/C8H14O/c1-3-4-5-6-7-8(2)9/h6-7H,3-5H2,1-2H3/b7-6+
InChIKeyZCFOBLITZWHNNC-VOTSOKGWSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) faeces (UBERON:0001988) PubMed (21970810)
ChEBI Ontology
Outgoing Relation(s)
3-Octen-2-one (CHEBI:89712) has functional parent acrylic acid (CHEBI:18308)
3-Octen-2-one (CHEBI:89712) is a olefinic compound (CHEBI:78840)
Synonyms  Source
(3E)-3-Octen-2-oneHMDB
(E)-3-Octen-2-oneHMDB
trans-3-Octen-2-oneHMDB
(3E)-oct-3-en-2-oneHMDB
FEMA 3416HMDB
Manual XrefsDatabases
HMDB0033547HMDB
Registry NumbersSources
CAS:1669-44-9KEGG COMPOUND
Citations