Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:54:32 UTC
Update Date2025-03-21 18:04:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00049426
Frequency66.7
Structure
Chemical FormulaC7H13NO4
Molecular Mass175.0845
SMILESNCCCCC(C(=O)O)C(=O)O
InChI KeyFRXKFOUBZFMNLB-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
  • 1,3-dicarbonyl compounds
  • amino fatty acids
  • branched fatty acids
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • amino fatty acid
  • branched fatty acid
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • medium-chain fatty acid
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound