Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:21 UTC
Update Date2025-03-21 18:35:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00106295
Frequency25.4
Structure
Chemical FormulaC9H17NO2
Molecular Mass171.1259
SMILESCCC(O)CCCC(=C=O)NC
InChI KeyFIEYVJHZAZACBQ-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
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • ynolates
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • secondary amine
  • organic oxide
  • ynolate
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine