Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:01:26 UTC
Update Date2025-03-21 23:05:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00630659
Frequency2.5
Structure
Chemical FormulaC8H12N2
Molecular Mass136.1
SMILESNCCNc1ccccc1
InChI KeyOCIDXARMXNJACB-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
  • monoalkylamines
  • organopnictogen compounds
  • secondary alkylarylamines
  • Substituents
  • monocyclic benzene moiety
  • secondary amine
  • secondary aliphatic/aromatic amine
  • aromatic homomonocyclic compound
  • organopnictogen compound
  • phenylalkylamine
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine