Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:32 UTC
Update Date2025-03-21 18:37:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00116479
Frequency22.5
Structure
Chemical FormulaC7H14N2O3
Molecular Mass174.1004
SMILESCN(CCCCCC(=O)O)N=O
InChI KeyMCYBANPABVITFU-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
  • monocarboxylic acids and derivatives
  • organic n-nitroso compounds
  • organic oxides
  • organopnictogen compounds
  • straight chain fatty acids
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • straight chain fatty acid
  • organic nitroso compound
  • carboxylic acid
  • carboxylic acid derivative
  • amino fatty acid
  • organic n-nitroso compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • medium-chain fatty acid
  • organic nitrogen compound
  • organooxygen compound