Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:15:03 UTC
Update Date2025-03-24 20:14:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01383487
Frequency0.9
Structure
Chemical FormulaC8H12N2
Molecular Mass136.1
SMILESCCNc1ccccc1N
InChI KeyFRPAGJPHUNNVLJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent phenylalkylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • secondary alkylarylamines
  • Substituents
  • monocyclic benzene moiety
  • secondary amine
  • secondary aliphatic/aromatic amine
  • aromatic homomonocyclic compound
  • organopnictogen compound
  • phenylalkylamine
  • hydrocarbon derivative
  • benzenoid
  • primary amine