Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:43:25 UTC
Update Date2025-03-24 17:56:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01018513
Frequency1.4
Structure
Chemical FormulaC3H5NO2
Molecular Mass87.032
SMILESNC(C=O)C=O
InChI KeyVMNLMAXKXUPCLB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent 1,3-dicarbonyl compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • aldehyde
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-dicarbonyl compound