Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:45 UTC
Update Date2025-03-21 18:39:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00126447
Frequency20.2
Structure
Chemical FormulaC12H12O
Molecular Mass172.0888
SMILESCC1(C)C=Cc2ccccc2C1=O
InChI KeyMVWSDWVTRYPWLS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • aryl alkyl ketones
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • Substituents
  • ketone
  • organic oxide
  • naphthalene
  • aryl alkyl ketone
  • organic oxygen compound
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • organooxygen compound
  • aryl ketone