Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:34 UTC
Update Date2025-03-25 01:00:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02241424
Frequency0.5
Structure
Chemical FormulaC7H12N2O5
Molecular Mass204.0746
SMILESCC(NC(=N)OC(C)C(=O)O)C(=O)O
InChI KeyUPUKJJAJGKXJCV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alanine and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • imines
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • imine
  • carboximidamide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • alanine or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound