Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:10:45 UTC
Update Date2025-03-25 01:20:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02363699
Frequency0.5
Structure
Chemical FormulaC3H5NO2S
Molecular Mass119.0041
SMILESOC1COC(S)=N1
InChI KeyDCVXAIYBSKCVQR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass oxazolines
Direct Parent oxazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkanolamines
  • azacyclic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • organosulfur compound
  • propargyl-type 1,3-dipolar organic compound
  • oxacycle
  • oxazoline
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • alkanolamine