Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:58:36 UTC
Update Date2025-03-24 20:33:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01486222
Frequency0.9
Structure
Chemical FormulaC7H10N2O
Molecular Mass138.0793
SMILESOC1CNc2cccn2C1
InChI KeyGZKWLLJIRMZMTA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent secondary alkylarylamines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrroles
  • secondary alcohols
  • Substituents
  • alcohol
  • azacycle
  • heteroaromatic compound
  • secondary aliphatic/aromatic amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound