Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:52 UTC
Update Date2025-03-25 00:46:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153155
Frequency0.5
Structure
Chemical FormulaC7H11NO4
Molecular Mass173.0688
SMILESNC(=O)C1CCC(O)(C(=O)O)C1
InChI KeyOXBRQABYMXGCCL-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
  • alpha hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • tertiary alcohols
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • hydroxy acid
  • cyclic alcohol
  • carboxamide group
  • carboxylic acid derivative
  • cyclopentanol
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound