Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:55 UTC
Update Date2025-03-21 18:02:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00040694
Frequency84.8
Structure
Chemical FormulaC3H6N2OS
Molecular Mass118.0201
SMILESNC1CSNC1=O
InChI KeySRIYQAKBWNTTFW-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
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • thiazolidinediones
  • thiazolidines
  • Substituents
  • carbonyl group
  • azacycle
  • thiazolidinedione
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound
  • thiazolidine