Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:26 UTC
Update Date2025-03-21 18:42:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00137364
Frequency18.2
Structure
Chemical FormulaC9H17NO3
Molecular Mass187.1208
SMILESNCC(O)C1CCC(C(=O)O)CC1
InChI KeyHAEHXVQRZKQLRB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound