EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:85482 - 6-(hexadecan-2-yl)-4-hydroxy-pyran-2-one

ChEBI IDCHEBI:85482
ChEBI Name6-(hexadecan-2-yl)-4-hydroxy-pyran-2-one
Stars
DefinitionA 6-alkyl-4-hydroxy-2H-pyran-2-one that is 4-hydroxy-2H-pyran-2-one in which the hydrogen at position 6 is replaced by a hexadecan-2-yl group.
Last Modified22 April 2015
Submitternhn
DownloadsMolfile
FormulaC21H36O3
Net Charge0
Average Mass336.516
Monoisotopic Mass336.26645
SMILESCCCCCCCCCCCCCCC(C)c1cc(O)cc(=O)o1
InChIInChI=1S/C21H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18(2)20-16-19(22)17-21(23)24-20/h16-18,22H,3-15H2,1-2H3
InChIKeyKUYGLUMCPODHIJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-(hexadecan-2-yl)-4-hydroxy-pyran-2-one (CHEBI:85482) is a 6-alkyl-4-hydroxy-2H-pyran-2-one (CHEBI:85514)
IUPAC Name 
6-(hexadecan-2-yl)-4-hydroxy-2H-pyran-2-one
Synonym  Source
2-methylhexadecanoyl triketide pyroneSUBMITTER
UniProt Name  Source
6-(hexadecan-2-yl)-4-hydroxy-pyran-2-oneUniProt
Registry NumbersSources
Reaxys:10198221Reaxys
Citations