Pentacosane-6,8-dione (CHEBI:185341)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Pentacosane-6,8-dione

ChEBI ID	CHEBI:185341

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C25H48O2

Net Charge

Average Mass

380.657

Monoisotopic Mass

380.36543

InChI

InChI=1S/C25H48O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-22-25(27)23-24(26)21-19-6-4-2/h3-23H2,1-2H3

InChIKey

ZQDADPUQAZWEGX-UHFFFAOYSA-N

SMILES

O=C(CCCCCCCCCCCCCCCCC)CC(=O)CCCCC

Metabolite of Species	Details
Bos taurus (NCBI:txid9913)	Found in spermatozoon (BTO:0001277). of strain Holstein [LBO:0000132] See: MetaboLights Study

ChEBI Ontology
Outgoing	Pentacosane-6,8-dione (CHEBI:185341) is a β-diketone (CHEBI:67265)

IUPAC Name

pentacosane-6,8-dione