Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:04 UTC
Update Date2025-03-21 18:37:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00117780
Frequency22.2
Structure
Chemical FormulaC5H11N3O2
Molecular Mass145.0851
SMILESCOC(=O)CCNC(=N)N
InChI KeyDCIFALCRBIFSEF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • imines
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • guanidine
  • imine
  • carboximidamide
  • beta amino acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound