Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:05 UTC
Update Date2025-03-21 18:39:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124822
Frequency20.6
Structure
Chemical FormulaC7H13NO5
Molecular Mass191.0794
SMILESNC1C(C(=O)O)CC(O)C(O)C1O
InChI KeyFSOQUTSVMXTRHE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • cyclitols and derivatives
  • cyclohexanols
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • cyclohexanol
  • cyclitol or derivatives
  • cyclic alcohol
  • beta amino acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound