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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:32:34 UTC
Update Date2025-03-24 21:40:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01854810
Frequency0.7
Structure
Chemical FormulaC3H7N3O
Molecular Mass101.0589
SMILESNC1=NC(N)CO1
InChI KeyLPRDNKDKHOQZQT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass oxazolines
Direct Parent oxazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • monoalkylamines
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • oxacycle
  • oxazoline
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound