Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:58 UTC
Update Date2025-03-25 00:54:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02203444
Frequency0.5
Structure
Chemical FormulaC9H13NO6
Molecular Mass231.0743
SMILESO=C(O)CC(=O)NC1CC(O)CC1C(=O)O
InChI KeyKOOZCIFTHQFYHG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclopentanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • cyclic alcohol
  • carboxamide group
  • carboxylic acid derivative
  • cyclopentanol
  • secondary carboxylic acid amide
  • organic oxide
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound