Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:47:25 UTC
Update Date2025-03-21 22:56:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00598207
Frequency2.7
Structure
Chemical FormulaC6H13NO
Molecular Mass115.0997
SMILESC=C(C)CC(O)CN
InChI KeyMGMXTTYVTJGUHJ-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