Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:49:46 UTC
Update Date2025-03-21 18:02:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00038005
Frequency92.2
Structure
Chemical FormulaC12H13N
Molecular Mass171.1048
SMILESNCCc1cccc2ccccc12
InChI KeyRUJHATQMIMUYKD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • naphthalene
  • organonitrogen compound
  • organopnictogen compound
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound