Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:55 UTC
Update Date2025-03-25 00:58:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02233104
Frequency0.5
Structure
Chemical FormulaC9H15NO4
Molecular Mass201.1001
SMILESCCC(C)C(=O)NC(=O)CCC(=O)O
InChI KeyBNTLPWUREBGYKB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent branched fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dicarboximides
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • n-unsubstituted carboxylic acid imides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • branched fatty acid
  • n-acyl-amine
  • carboxylic acid imide
  • carboxylic acid imide, n-unsubstituted
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • dicarboximide
  • organic nitrogen compound
  • organooxygen compound