Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:00:36 UTC
Update Date2025-03-21 20:10:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00344425
Frequency5.5
Structure
Chemical FormulaC7H11NO2
Molecular Mass141.079
SMILESO=C(O)C1CC2CCC2N1
InChI KeyBDLGSQLNAHOHEE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • azepanes
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • pyrrolidine carboxylic acids
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid
  • aliphatic heteropolycyclic compound
  • organic oxide
  • pyrrolidine carboxylic acid
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • monocarboxylic acid or derivatives
  • pyrrolidine carboxylic acid or derivatives
  • azepane
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine