Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:01 UTC
Update Date2025-03-25 00:58:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231036
Frequency0.5
Structure
Chemical FormulaC8H15NO2S
Molecular Mass189.0824
SMILESCCN(CC)C(=S)C(C)C(=O)O
InChI KeyYCSWXAMQEXBLAJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthioamides
Subclass thioamides
Direct Parent thioamides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • thiocarbonyl compounds
  • thiocarboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • thiocarboxylic acid amide
  • thiocarbonyl group
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioamide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound