EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:74295 - 6-[2-(2,4-dihydroxy-6-methylphenyl)-2-oxoethyl]-4-hydroxy-pyran-2-one

ChEBI IDCHEBI:74295
ChEBI Name6-[2-(2,4-dihydroxy-6-methylphenyl)-2-oxoethyl]-4-hydroxy-pyran-2-one
Stars
DefinitionA member of the class of 2-pyranones that is 2H-pyran-2-one in which the hydrogens at positions 4 and 6 are substituted by hydroxy and (2,4-dihydroxy-6-methylphenyl)-2-oxoethyl groups respectively.
Last Modified10 October 2013
Submittermwilliams
DownloadsMolfile
FormulaC14H12O6
Net Charge0
Average Mass276.244
Monoisotopic Mass276.06339
SMILESCc1cc(O)cc(O)c1C(=O)Cc1cc(O)cc(=O)o1
InChIInChI=1S/C14H12O6/c1-7-2-8(15)4-11(17)14(7)12(18)6-10-3-9(16)5-13(19)20-10/h2-5,15-17H,6H2,1H3
InChIKeyJIBVOQAUTOPGPH-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
6-[2-(2,4-dihydroxy-6-methylphenyl)-2-oxoethyl]-4-hydroxy-pyran-2-one (CHEBI:74295) has functional parent 2H-pyran-2-one (CHEBI:37965)
6-[2-(2,4-dihydroxy-6-methylphenyl)-2-oxoethyl]-4-hydroxy-pyran-2-one (CHEBI:74295) has role metabolite (CHEBI:25212)
6-[2-(2,4-dihydroxy-6-methylphenyl)-2-oxoethyl]-4-hydroxy-pyran-2-one (CHEBI:74295) is a 2-pyranones (CHEBI:75885)
6-[2-(2,4-dihydroxy-6-methylphenyl)-2-oxoethyl]-4-hydroxy-pyran-2-one (CHEBI:74295) is a polyketide (CHEBI:26188)
6-[2-(2,4-dihydroxy-6-methylphenyl)-2-oxoethyl]-4-hydroxy-pyran-2-one (CHEBI:74295) is a resorcinols (CHEBI:33572)
IUPAC Name 
6-[2-(2,4-dihydroxy-6-methylphenyl)-2-oxoethyl]-4-hydroxy-2H-pyran-2-one
Registry NumbersSources
Reaxys:23144242Reaxys