Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:42:13 UTC
Update Date2025-03-24 21:18:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01735529
Frequency0.7
Structure
Chemical FormulaC5H8N2OS
Molecular Mass144.0357
SMILESNC(=O)C1CCSC=N1
InChI KeyRYCHQKPZJSIXHL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-thiazines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • azacycle
  • organic 1,3-dipolar compound
  • carboxamide group
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • meta-thiazine
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound