Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:58 UTC
Update Date2025-03-25 00:49:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176148
Frequency0.5
Structure
Chemical FormulaC14H20O2
Molecular Mass220.1463
SMILESCC(C)c1cccc(C(=O)C(C)(C)C)c1O
InChI KeyGFMPLJWSNSALTP-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-4-unsubstituted benzenoids
  • aryl alkyl ketones
  • benzoyl derivatives
  • cumenes
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • phenylpropanes
  • vinylogous acids
  • Substituents
  • monocyclic benzene moiety
  • aryl alkyl ketone
  • benzoyl
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylpropane
  • aromatic homomonocyclic compound
  • vinylogous acid
  • organic oxide
  • phenol
  • cumene
  • hydrocarbon derivative
  • benzenoid
  • alkyl-phenylketone