Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:03:41 UTC
Update Date2025-03-25 01:17:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02347923
Frequency0.5
Structure
Chemical FormulaC6H10NO3+
Molecular Mass144.0655
SMILESO=C(O)C(O)C1CCC[N+]1
InChI KeyPNSYQPQSAGWCMG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass alpha hydroxy acids and derivatives
Direct Parent alpha hydroxy acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidines
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • azacycle
  • alpha-hydroxy acid
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • pyrrolidine
  • organoheterocyclic compound
  • organooxygen compound