Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:58 UTC
Update Date2025-03-25 00:48:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169205
Frequency0.5
Structure
Chemical FormulaC6H14N2O3S
Molecular Mass194.0725
SMILESCCCNC(=O)C(N)CS(=O)O
InChI KeyOGQZGCOLLATYNK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid amides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkanesulfinic acids and derivatives
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • secondary carboxylic acid amides
  • sulfinic acids
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • alpha-amino acid amide
  • sulfinic acid derivative
  • organosulfur compound
  • carboxamide group
  • sulfinic acid
  • alkanesulfinic acid or derivatives
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound