Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:27:18 UTC
Update Date2025-03-21 23:17:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00691824
Frequency2.3
Structure
Chemical FormulaC8H12N2
Molecular Mass136.1
SMILESCNc1c(C)cccc1N
InChI KeyLITJVIDAGYUHGN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass toluenes
Direct Parent diaminotoluenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organopnictogen compounds
  • phenylalkylamines
  • primary amines
  • secondary alkylarylamines
  • toluenes
  • Substituents
  • diaminotoluene
  • secondary amine
  • secondary aliphatic/aromatic amine
  • aromatic homomonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • phenylalkylamine
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine