CHEBI:88652 - 3,4-Hexanedione

ChEBI IDCHEBI:88652
ChEBI Name3,4-Hexanedione
Stars
DownloadsMolfile
FormulaC6H10O2
Net Charge0
Average Mass114.144
Monoisotopic Mass114.06808
SMILESCCC(=O)C(=O)CC
InChIInChI=1S/C6H10O2/c1-3-5(7)6(8)4-2/h3-4H2,1-2H3
InChIKeyKVFQMAZOBTXCAZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) faeces (UBERON:0001988) PubMed (17314143)
ChEBI Ontology
Outgoing Relation(s)
3,4-Hexanedione (CHEBI:88652) is a α-diketone (CHEBI:51869)
Synonyms  Source
BipropionylHMDB
Diethyl diketoneHMDB
hexane-3,4-dioneHMDB
3,4-HexandioneHMDB
FEMA 3168HMDB
DipropionylHMDB
Manual XrefsDatabases
HMDB0031492HMDB
Registry NumbersSources
CAS:4437-51-8KEGG COMPOUND
Citations