Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:24:04 UTC
Update Date2025-03-21 23:16:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00684163
Frequency2.3
Structure
Chemical FormulaC5H11NO2
Molecular Mass117.079
SMILESC[N+]1([O-])CCC(O)C1
InChI KeyHDDMHTPGEHDMRF-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
  • hydrocarbon derivatives
  • organic oxides
  • organic oxoanionic compounds
  • organopnictogen compounds
  • secondary alcohols
  • trialkyl amine oxides
  • trisubstituted amine oxides and derivatives
  • Substituents
  • alcohol
  • azacycle
  • n-alkylpyrrolidine
  • n-oxide
  • trialkyl amine oxide
  • organic oxide
  • organic oxygen compound
  • trisubstituted n-oxide
  • aminoxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • organic hyponitrite