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CHEBI:172649 - 10,12-Heptacosanedione

ChEBI IDCHEBI:172649
ChEBI Name10,12-Heptacosanedione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H52O2
Net Charge0
Average Mass408.711
Monoisotopic Mass408.39673
SMILESCCCCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCC
InChIInChI=1S/C27H52O2/c1-3-5-7-9-11-12-13-14-15-16-18-20-22-24-27(29)25-26(28)23-21-19-17-10-8-6-4-2/h3-25H2,1-2H3
InChIKeySMZYJVMNHONWKX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
10,12-Heptacosanedione (CHEBI:172649) is a β-diketone (CHEBI:67265)
IUPAC Name 
heptacosane-10,12-dione
Manual XrefsDatabases
30776804ChemSpider
HMDB0029997HMDB