Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:40:59 UTC
Update Date2025-03-21 17:58:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00017533
Frequency240.1
Structure
Chemical FormulaC12H14N2
Molecular Mass186.1157
SMILESc1ccc2c(C3CCCN3)c[nH]c2c1
InChI KeyMAVAXPFTVGSHTB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrroles
  • pyrrolidines
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • indole
  • heteroaromatic compound
  • secondary amine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • pyrrolidine
  • amine