EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:84150 - 4-hydroxy-6-(2-oxotridecyl)pyran-2-one

ChEBI IDCHEBI:84150
ChEBI Name4-hydroxy-6-(2-oxotridecyl)pyran-2-one
Stars
DefinitionA 2-pyranone in which the hydrogens at positions 4 and 6 of 2H-pyran-2-one are replaced by hydroxy and 2-oxotridecyl groups respectively.
Last Modified14 June 2018
Submitternhn
DownloadsMolfile
FormulaC18H28O4
Net Charge0
Average Mass308.418
Monoisotopic Mass308.19876
SMILESCCCCCCCCCCCC(=O)Cc1cc(O)cc(=O)o1
InChIInChI=1S/C18H28O4/c1-2-3-4-5-6-7-8-9-10-11-15(19)12-17-13-16(20)14-18(21)22-17/h13-14,20H,2-12H2,1H3
InChIKeyGPSLPPYNZMBYDU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-hydroxy-6-(2-oxotridecyl)pyran-2-one (CHEBI:84150) is a 2-pyranones (CHEBI:75885)
4-hydroxy-6-(2-oxotridecyl)pyran-2-one (CHEBI:84150) is a heteroaryl hydroxy compound (CHEBI:74818)
4-hydroxy-6-(2-oxotridecyl)pyran-2-one (CHEBI:84150) is a ketone (CHEBI:17087)
IUPAC Name 
4-hydroxy-6-(2-oxotridecyl)-2H-pyran-2-one
Synonym  Source
lauroyl tetraketide pyroneSUBMITTER
UniProt Name  Source
4-hydroxy-6-(2-oxotridecyl)pyran-2-oneUniProt
Registry NumbersSources
Reaxys:9941362Reaxys
Citations