CHEBI:172696 - 8,10-Hentriacontanedione

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 8,10-Hentriacontanedione
ChEBI ID CHEBI:172696
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C31H60O2
Net Charge 0
Average Mass 464.819
Monoisotopic Mass 464.45933
InChI InChI=1S/C31H60O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-26-28-31(33)29-30(32)27-25-23-8-6-4-2/h3-29H2,1-2H3
InChIKey AFUNKBMLTPDWPX-UHFFFAOYSA-N
SMILES O=C(CCCCCCCCCCCCCCCCCCCCC)CC(=O)CCCCCCC
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing 8,10-Hentriacontanedione (CHEBI:172696) is a β-diketone (CHEBI:67265)
IUPAC Name
hentriacontane-8,10-dione
Manual Xrefs Databases
16372452 ChemSpider
HMDB0035531 HMDB
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