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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:44:43 UTC
Update Date2025-03-24 22:12:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02025892
Frequency0.6
Structure
Chemical FormulaC7H12N2O
Molecular Mass140.095
SMILESCC1=NCC(C(C)O)N=C1
InChI KeyWDFKCAVVEYNLEQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass imines
Direct Parent ketimines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • ketimine
  • azacycle
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound