Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:34 UTC
Update Date2025-03-25 00:53:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02197911
Frequency0.5
Structure
Chemical FormulaC8H13N
Molecular Mass123.1048
SMILESCN1C=CC(C)(C)C=C1
InChI KeyVYZBAUDQLJLKLO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent dihydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • enamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • azacycle
  • tertiary aliphatic amine
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • dihydropyridine
  • amine
  • tertiary amine
  • enamine