Hmdb loader

Showing information for DMID00105548

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:03 UTC
Update Date2025-03-21 18:35:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00105548
Frequency25.6
Structure
Chemical FormulaC9H13NO6
Molecular Mass231.0743
SMILESO=C1CCN(C2OC(CO)C(O)C2O)C1=O
InChI KeyCDMAPHZCOPEUQN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboxylic acids and derivatives
  • cyclic ketones
  • hydrocarbon derivatives
  • lactams
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • pyrrolidine-2-ones
  • pyrrolidine-3-ones
  • secondary alcohols
  • tertiary carboxylic acid amides
  • tetrahydrofurans
    • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • 3-pyrrolidone
  • monosaccharide
  • cyclic ketone
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • tertiary carboxylic acid amide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • primary alcohol
  • pyrrolidone
  • organoheterocyclic compound
  • alcohol
  • azacycle
  • n-alkylpyrrolidine
  • tetrahydrofuran
  • carboxamide group
  • oxacycle
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound