Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:07 UTC
Update Date2025-03-21 18:34:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00103278
Frequency26.3
Structure
Chemical FormulaC10H12O2
Molecular Mass164.0837
SMILESCCOc1ccccc1C(C)=O
InChI KeyTVGMOUGXQYQZOL-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
  • acetophenones
  • alkyl aryl ethers
  • aryl alkyl ketones
  • benzoyl derivatives
  • hydrocarbon derivatives
  • organic oxides
  • phenol ethers
  • phenoxy compounds
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • aryl alkyl ketone
  • benzoyl
  • alkyl aryl ether
  • aromatic homomonocyclic compound
  • organic oxide
  • acetophenone
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • alkyl-phenylketone