CHEBI:5660 - hentriacontane-14,16-dione

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ChEBI Name hentriacontane-14,16-dione
ChEBI ID CHEBI:5660
Definition A β-diketone that is hentriacontane in which the hydrogens at position 14 and 16 are replaced by oxo groups.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C31H60O2
Net Charge 0
Average Mass 464.80690
Monoisotopic Mass 464.45933
InChI InChI=1S/C31H60O2/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-28-31(33)29-30(32)27-25-23-21-19-17-14-12-10-8-6-4-2/h3-29H2,1-2H3
InChIKey LZBJUTTUMRSJBP-UHFFFAOYSA-N
SMILES CCCCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCCCCCC
ChEBI Ontology
Outgoing hentriacontane-14,16-dione (CHEBI:5660) has parent hydride hentriacontane (CHEBI:5659)
hentriacontane-14,16-dione (CHEBI:5660) is a β-diketone (CHEBI:67265)
IUPAC Name
hentriacontane-14,16-dione
Synonym Source
Hentriacontane-14,16-dione KEGG COMPOUND
Manual Xrefs Databases
C00001251 KNApSAcK
C08377 KEGG COMPOUND
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Registry Numbers Types Sources
1915766 Beilstein Registry Number Beilstein
1915766 Reaxys Registry Number Reaxys
24724-84-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014