Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:50:38 UTC
Update Date2025-03-24 17:59:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01035772
Frequency1.3
Structure
Chemical FormulaC9H11N
Molecular Mass133.0891
SMILESCN1CC1c1ccccc1
InChI KeyNTWLTKMOHDXNCK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aralkylamines
  • azacyclic compounds
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organopnictogen compounds
  • phenylaziridines
  • trialkylamines
  • Substituents
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • azacycle
  • indole
  • tertiary aliphatic amine
  • aralkylamine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • aziridine
  • tertiary amine
  • phenylaziridine