Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:50:07 UTC
Update Date2025-03-21 21:59:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00461947
Frequency3.8
Structure
Chemical FormulaC4H7NOS
Molecular Mass117.0248
SMILESC=CCSC(N)=O
InChI KeyOMGBBXADMVNVRR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolactones
Subclass thiolactones
Direct Parent thiolactones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • allyl sulfur compounds
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carbonic acid derivative
  • sulfenyl compound
  • allyl sulfur compound
  • organosulfur compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • thiolactone
  • organooxygen compound