Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:33:09 UTC
Update Date2025-03-24 14:28:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00850545
Frequency1.7
Structure
Chemical FormulaC6H13NO
Molecular Mass115.0997
SMILESCCCCC(O)C=N
InChI KeyIFFBWGNWPIBJAG-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
  • carbonyl compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound