Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:10 UTC
Update Date2025-03-25 01:01:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02252082
Frequency0.5
Structure
Chemical FormulaC5H8N2O3
Molecular Mass144.0535
SMILESNC1COC(=O)CNC1=O
InChI KeyHNLLVJKURSWUIX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent cyclic peptides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,4-oxazepines
  • alpha amino acid esters
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • lactams
  • lactones
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • alpha-amino acid or derivatives
  • lactone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • alpha-amino acid ester
  • azacycle
  • carboxamide group
  • para-oxazepine
  • oxacycle
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • cyclic alpha peptide
  • carboxylic acid ester
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound