Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:19:36 UTC
Update Date2025-03-21 20:52:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00389362
Frequency4.7
Structure
Chemical FormulaC6H15NO
Molecular Mass117.1154
SMILESCC(N)CCC(C)O
InChI KeyXHKYHXSLZPTQLZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound