Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:57 UTC
Update Date2025-03-21 18:02:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00040799
Frequency84.5
Structure
Chemical FormulaC12H14O2
Molecular Mass190.0994
SMILESO=C(O)CC1CCCc2ccccc21
InChI KeyJMLRZDXOJMFVPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • tetralin
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid
  • organic oxygen compound
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • carboxylic acid derivative
  • organooxygen compound