Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:00:37 UTC
Update Date2025-03-21 20:10:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00344435
Frequency5.5
Structure
Chemical FormulaC5H9NO
Molecular Mass99.0684
SMILESNC1C=CC(O)C1
InChI KeyNPHHAQOEPZJMNE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound