Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:33 UTC
Update Date2025-03-21 18:39:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00123592
Frequency20.9
Structure
Chemical FormulaC4H6N2O5S
Molecular Mass193.9997
SMILESCC(=O)NC1OS(=O)(=O)NC1=O
InChI KeyURBSQAAHTSJFOL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent n-acyl-alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organic sulfuric acids and derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxathiazolidines
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • organic sulfuric acid or derivatives
  • azacycle
  • 1,2,3-oxathiazolidine
  • n-acyl-alpha-amino acid
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • acetamide
  • organooxygen compound