Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:17 UTC
Update Date2025-03-25 00:58:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231640
Frequency0.5
Structure
Chemical FormulaC16H22N2
Molecular Mass242.1783
SMILESCC1CCN(CCc2c[nH]c3ccccc23)CC1
InChI KeyOHBTXBINURLNDS-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
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • piperidines
  • pyrroles
  • trialkylamines
  • Substituents
  • azacycle
  • indole
  • heteroaromatic compound
  • tertiary aliphatic amine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine