Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:02:43 UTC
Update Date2025-03-21 18:07:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00068654
Frequency44.1
Structure
Chemical FormulaC11H15N3
Molecular Mass189.1266
SMILESCN(C)CCc1c[nH]c2cnccc12
InChI KeyUMTVQTSKTFGRIF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • organopnictogen compounds
  • pyrroles
  • trialkylamines
  • Substituents
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • methylpyridine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine