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CHEBI:66037 - 1-hydroxy-5-phenyl-3-pentanone

ChEBI IDCHEBI:66037
ChEBI Name1-hydroxy-5-phenyl-3-pentanone
Stars
DefinitionA β-hydroxy ketone that is pentan-3-one with a hydroxy group at position 1 and a phenyl group at position 5. Isolated from the edible mushroom Mycoleptodonoides aitchisonii, it exhibits protective activity against endoplasmic reticulum (ER) stress-dependent cell death.
Last Modified25 February 2013
DownloadsMolfile
FormulaC11H14O2
Net Charge0
Average Mass178.231
Monoisotopic Mass178.09938
SMILESO=C(CCO)CCc1ccccc1
InChIInChI=1S/C11H14O2/c12-9-8-11(13)7-6-10-4-2-1-3-5-10/h1-5,12H,6-9H2
InChIKeyVQTZONPDOFOTIF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mycoleptodonoides aitchisonii (ncbitaxon:1076280) - DOI (10.1016/j.tet.2008.10.068)
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.
Application:
neuroprotective agent  Any compound that can be used for the treatment of neurodegenerative disorders.
ChEBI Ontology
Outgoing Relation(s)
1-hydroxy-5-phenyl-3-pentanone (CHEBI:66037) has role metabolite (CHEBI:25212)
1-hydroxy-5-phenyl-3-pentanone (CHEBI:66037) has role neuroprotective agent (CHEBI:63726)
1-hydroxy-5-phenyl-3-pentanone (CHEBI:66037) is a primary alcohol (CHEBI:15734)
1-hydroxy-5-phenyl-3-pentanone (CHEBI:66037) is a β-hydroxy ketone (CHEBI:55380)
IUPAC Name 
1-hydroxy-5-phenylpentan-3-one
Registry NumbersSources
Reaxys:7805954Reaxys