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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:07 UTC
Update Date2025-03-25 00:49:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171875
Frequency0.5
Structure
Chemical FormulaC8H17N3O3
Molecular Mass203.127
SMILESCNC(=N)NOCCCCCC(=O)O
InChI KeyYEEGZKKBOICDLO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass medium-chain hydroxy acids and derivatives
Direct Parent medium-chain hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amino fatty acids
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • guanidines
  • hydrocarbon derivatives
  • imines
  • medium-chain fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • straight chain fatty acids
    • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • straight chain fatty acid
  • carboxylic acid
  • guanidine
  • imine
  • fatty acid
  • carboximidamide
  • carboxylic acid derivative
  • amino fatty acid
  • medium-chain hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • medium-chain fatty acid
  • organic nitrogen compound
  • organooxygen compound