Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:33:34 UTC
Update Date2025-03-21 21:51:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00422791
Frequency4.2
Structure
Chemical FormulaC6H15NO
Molecular Mass117.1154
SMILESCCCC(C)(O)CN
InChI KeyJSELUEZGSGRXKT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound