Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:23:00 UTC
Update Date2025-03-25 01:02:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02253881
Frequency0.5
Structure
Chemical FormulaC14H20O
Molecular Mass204.1514
SMILESCC(C)Cc1cccc(C(=O)C(C)C)c1
InChI KeySLVYJTDWVQFWHN-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
  • aryl alkyl ketones
  • benzoyl derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • phenylpropanes
  • Substituents
  • monocyclic benzene moiety
  • aryl alkyl ketone
  • benzoyl
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • hydrocarbon derivative
  • benzenoid
  • alkyl-phenylketone