Hmdb loader

Showing information for DMID02209327

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:30 UTC
Update Date2025-03-25 00:54:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02209327
Frequency0.5
Structure
Chemical FormulaC12H14N2
Molecular Mass186.1157
SMILESCC1(C)CCNc2ccc(C#N)cc21
InChI KeyCBQNGYUHZWPBQE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass hydroquinolines
Direct Parent hydroquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • hydrocarbon derivatives
  • nitriles
  • organopnictogen compounds
  • secondary alkylarylamines
    • Substituents
  • nitrile
  • azacycle
  • secondary amine
  • secondary aliphatic/aromatic amine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • tetrahydroquinoline
  • amine
  • carbonitrile