Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:45:03 UTC
Update Date2025-03-24 14:02:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00734796
Frequency2.1
Structure
Chemical FormulaC7H10N2O
Molecular Mass138.0793
SMILESOCCNc1cccnc1
InChI KeySNXJFWSNRZMEKJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent secondary alkylarylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkanolamines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • organopnictogen compounds
  • Substituents
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • secondary aliphatic/aromatic amine
  • pyridine
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound
  • alkanolamine