Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:18:12 UTC
Update Date2025-03-21 19:10:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00246530
Frequency8.5
Structure
Chemical FormulaC9H13N
Molecular Mass135.1048
SMILESCCc1ccccc1CN
InChI KeyJPYXQNWIQIBLJT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound