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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:12 UTC
Update Date2025-03-25 00:48:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02167509
Frequency0.5
Structure
Chemical FormulaC12H24N4O5S
Molecular Mass336.1467
SMILESCC(=O)NC1C(SCCCN=C(N)N)OC(CO)C(O)C1O
InChI KeyUVICUEKBTZHDJI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids and derivatives
  • guanidines
  • hydrocarbon derivatives
  • monothioacetals
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • sulfenyl compounds
    • Substituents
  • carbonyl group
  • guanidine
  • monosaccharide
  • organosulfur compound
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • monothioacetal
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • acetamide
  • alcohol
  • sulfenyl compound
  • organic 1,3-dipolar compound
  • carboximidamide
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound