Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:04:43 UTC
Update Date2025-03-25 00:55:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02212281
Frequency0.5
Structure
Chemical FormulaC20H32O
Molecular Mass288.2453
SMILESCCCCCCCCCCCC(=O)c1c(C)cccc1C
InChI KeyIPQNXWGRXGXLOO-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
  • butyrophenones
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • m-xylenes
  • Substituents
  • monocyclic benzene moiety
  • aryl alkyl ketone
  • m-xylene
  • benzoyl
  • butyrophenone
  • aromatic homomonocyclic compound
  • xylene
  • organic oxide
  • hydrocarbon derivative
  • benzenoid
  • alkyl-phenylketone