Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:26:32 UTC
Update Date2025-03-25 01:26:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02400421
Frequency0.5
Structure
Chemical FormulaC7H13NO2
Molecular Mass143.0946
SMILESCC(=O)OC1CCCN1C
InChI KeyJNNGGFHOTUBNRS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • azacycle
  • n-alkylpyrrolidine
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound