Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:12:26 UTC
Update Date2025-03-21 18:32:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00091813
Frequency30.5
Structure
Chemical FormulaC4H10N2OS
Molecular Mass134.0514
SMILESNC(=O)CC(N)CS
InChI KeyBFVZBPPCNKSMMK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • carbonyl compounds
  • carboxylic acids and derivatives
  • fatty amides
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • fatty amide
  • organosulfur compound
  • carboxamide group
  • beta amino acid or derivatives
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol
  • organooxygen compound