Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:21 UTC
Update Date2025-03-25 00:58:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231782
Frequency0.5
Structure
Chemical FormulaC12H15N
Molecular Mass173.1204
SMILESCC12CCCN1c1ccccc1C2
InChI KeyZMPQBPRZBYFGJT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • dialkylarylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrrolidines
  • Substituents
  • azacycle
  • indole
  • aromatic heteropolycyclic compound
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • dialkylarylamine
  • pyrrolidine
  • amine
  • tertiary amine