Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:10:30 UTC
Update Date2025-03-25 01:20:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02363174
Frequency0.5
Structure
Chemical FormulaC7H8N2O
Molecular Mass136.0637
SMILESCOc1cccc2[nH][nH]c12
InChI KeySMJKZBDWGCQXAP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • ether
  • azacycle
  • heteroaromatic compound
  • alkyl aryl ether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound