Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:43 UTC
Update Date2025-03-25 00:52:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02193730
Frequency0.5
Structure
Chemical FormulaC12H18N2O2
Molecular Mass222.1368
SMILESCN(C)CC1COC(C)(c2cccnc2)O1
InChI KeyZBTJQIYGKUXAGT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass methylpyridines
Direct Parent methylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • ketals
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • trialkylamines
  • Substituents
  • meta-dioxolane
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • tertiary aliphatic amine
  • methylpyridine
  • oxacycle
  • organic oxygen compound
  • acetal
  • ketal
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound