Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:26 UTC
Update Date2025-03-21 17:58:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00014160
Frequency462.1
Structure
Chemical FormulaC10H12N2O
Molecular Mass176.095
SMILESNC(=O)N1CCc2ccccc2C1
InChI KeyNCOFBBARJYKKNL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydroisoquinolines
Subclass tetrahydroisoquinolines
Direct Parent tetrahydroisoquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • tetrahydroisoquinoline
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound