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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:11 UTC
Update Date2025-03-25 01:01:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02252106
Frequency0.5
Structure
Chemical FormulaC11H23N3O7
Molecular Mass309.1536
SMILESNCCCC(C(=O)O)N(N)C1OC(CO)C(O)C(O)C1O
InChI KeyTXJRLCNVSGCQHL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkylhydrazines
  • carbonyl compounds
  • carboxylic acids
  • heterocyclic fatty acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • Substituents
  • fatty acyl
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • heterocyclic fatty acid
  • monosaccharide
  • fatty acid
  • alkylhydrazine
  • saccharide
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydroxy fatty acid
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • hydrazine derivative
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound