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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:20 UTC
Update Date2025-03-25 00:55:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213717
Frequency0.5
Structure
Chemical FormulaC18H18ClNO2
Molecular Mass315.1026
SMILESCNC1CCC(c2ccc(Cl)cc2)c2cc(C(=O)O)ccc21
InChI KeyNATMUAAHLBMETB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tametralines
Direct Parent tametralines
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • amino acids
  • aryl chlorides
  • carboxylic acids
  • chlorobenzenes
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • naphthalenecarboxylic acids
  • organic oxides
  • organochlorides
  • organooxygen compounds
  • organopnictogen compounds
    • Substituents
  • monocyclic benzene moiety
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • organochloride
  • carboxylic acid derivative
  • organohalogen compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • aryl chloride
  • chlorobenzene
  • secondary aliphatic amine
  • aromatic homopolycyclic compound
  • secondary amine
  • aryl halide
  • tametraline
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • 2-naphthalenecarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • 2-naphthalenecarboxylic acid
  • halobenzene
  • organooxygen compound
  • amine