Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:13:54 UTC
Update Date2025-03-21 19:07:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00236361
Frequency9.0
Structure
Chemical FormulaC4H5NOS
Molecular Mass115.0092
SMILESO=C1C=CSCN1
InChI KeyLRGHJVHXTABNTR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiazines
Subclass 1,3-thiazines
Direct Parent 1,3-thiazines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • thioenol ethers
  • thiohemiaminal derivatives
  • vinylogous thioesters
  • Substituents
  • vinylogous thioester
  • carbonyl group
  • lactam
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • organic oxide
  • thioenolether
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • hemithioaminal
  • organopnictogen compound
  • meta-thiazine
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound