Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:43 UTC
Update Date2025-03-21 18:35:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107208
Frequency25.1
Structure
Chemical FormulaC7H9NO2
Molecular Mass139.0633
SMILESOCCOc1ccccn1
InChI KeyRKBOVIXFWKGJLG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent alkyl aryl ethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • alcohols and polyols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • alkyl aryl ether
  • pyridine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organoheterocyclic compound