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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:33 UTC
Update Date2025-03-25 00:57:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02223440
Frequency0.5
Structure
Chemical FormulaC10H17N3O7
Molecular Mass291.1066
SMILESNC(N)=NC1C(O)C=C(C(=O)O)OC1C(O)C(O)CO
InChI KeyIGDWBVRRKMGXPQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass guanidines
Direct Parent guanidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • guanidine
  • organic 1,3-dipolar compound
  • carboximidamide
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound