Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:13:47 UTC
Update Date2025-03-21 18:33:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00095085
Frequency29.2
Structure
Chemical FormulaC14H14O2
Molecular Mass214.0994
SMILESCOC(=O)CCc1cccc2ccccc12
InChI KeyAZYKDLCVKJULJI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • fatty acid esters
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • fatty acyl
  • carbonyl group
  • aromatic homopolycyclic compound
  • carboxylic acid derivative
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • naphthalene
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound