Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:59:24 UTC
Update Date2025-03-21 18:06:03 UTC
HMDB IDHMDB0032128
Metabolite Identification
DeepMet IDDMID00060772
Name1-(2,4-Dihydroxyphenyl)-1-butanone
Frequency51.4
Structure
Chemical FormulaC10H12O3
Molecular Mass180.0786
SMILESCCCC(=O)c1ccc(O)cc1O
InChI KeyIWADIQGGJLCBRK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alkyl-phenylketones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aryl alkyl ketones
  • benzoyl derivatives
  • butyrophenones
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • resorcinols
  • vinylogous acids
  • Substituents
  • monocyclic benzene moiety
  • aryl alkyl ketone
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • resorcinol
  • butyrophenone
  • aromatic homomonocyclic compound
  • vinylogous acid
  • organic oxide
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • alkyl-phenylketone