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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:43:21 UTC
Update Date2025-03-21 22:55:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00588367
Frequency2.8
Structure
Chemical FormulaC3H8N2O2
Molecular Mass104.0586
SMILESCC(O)C(N)N=O
InChI KeyVITLSQHUVDFOCY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • c-nitroso compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • organic nitroso compound
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • c-nitroso compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound