Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:57:32 UTC
Update Date2025-03-25 01:38:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02473246
Frequency0.5
Structure
Chemical FormulaC6H13NO2
Molecular Mass131.0946
SMILESCCC(C)C(O)=NOC
InChI KeyJFQLPXPZSKCORC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass organonitrogen compounds
Direct Parent organonitrogen compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound