Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:57 UTC
Update Date2025-03-21 18:41:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00136221
Frequency18.4
Structure
Chemical FormulaC11H15NO2
Molecular Mass193.1103
SMILESOC1CCC(O)(c2cccnc2)CC1
InChI KeyIYTNCPNSQOYEKD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • cyclic alcohols and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary alcohols
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • cyclohexanol
  • cyclic alcohol
  • tertiary alcohol
  • pyridine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound