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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:26 UTC
Update Date2025-03-25 00:52:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02193082
Frequency0.5
Structure
Chemical FormulaC8H15NO3
Molecular Mass173.1052
SMILESCCCC(CC)C(=NO)C(=O)O
InChI KeyFBBJYVNAEHTYAY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent medium-chain fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amino fatty acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • ketoximes
  • methyl-branched fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • ketoxime
  • carboxylic acid derivative
  • amino fatty acid
  • branched fatty 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