Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:30 UTC
Update Date2025-03-25 00:57:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02227705
Frequency0.5
Structure
Chemical FormulaC6H12N2O3
Molecular Mass160.0848
SMILESCC(=NC(O)C(C)O)C(N)=O
InChI KeyGAOAUAHCTOIMQQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass imines
Direct Parent secondary ketimines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkanolamines
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • primary carboxylic acid amides
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
  • Substituents
  • primary carboxylic acid amide
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • organic 1,3-dipolar compound
  • carboxamide group
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • secondary ketimine
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound
  • alkanolamine