Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:07:16 UTC
Update Date2025-03-24 20:36:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01507075
Frequency0.8
Structure
Chemical FormulaC5H7NO4
Molecular Mass145.0375
SMILESO=C=NCC(O)CC(=O)O
InChI KeyHCURMLMVNZHNQD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • isocyanates
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • gamma amino acid or derivatives
  • fatty acid
  • propargyl-type 1,3-dipolar organic compound
  • beta-hydroxy acid
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydroxy fatty acid
  • alcohol
  • isocyanate
  • organic 1,3-dipolar compound
  • hydroxy acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound