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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:16 UTC
Update Date2025-03-25 00:59:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02238452
Frequency0.5
Structure
Chemical FormulaC12H21NO6
Molecular Mass275.1369
SMILESO=C(O)C(O)CCNCC1CCC(O)(C(=O)O)CC1
InChI KeyMNDYGPOOEFAWBD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • amino acids
  • carbocyclic fatty acids
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • cyclohexanols
  • dialkylamines
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monosaccharides
  • organic oxides
  • organopnictogen compounds
  • short-chain hydroxy acids and derivatives
  • tertiary alcohols
  • Substituents
  • fatty acyl
  • carbocyclic fatty acid
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • amino acid
  • gamma amino acid or derivatives
  • alpha-hydroxy acid
  • monosaccharide
  • fatty acid
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydroxy fatty acid
  • alcohol
  • secondary aliphatic amine
  • cyclohexanol
  • hydroxy acid
  • cyclic alcohol
  • secondary amine
  • tertiary alcohol
  • organic oxygen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine