Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:06:00 UTC
Update Date2025-03-21 23:07:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00641425
Frequency2.5
Structure
Chemical FormulaC8H12N2
Molecular Mass136.1
SMILESCC(N)c1cccc(N)c1
InChI KeyMBWYRMCXWROJMP-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
  • organopnictogen compounds
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • primary amine
  • organic nitrogen compound
  • amine