Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:32:01 UTC
Update Date2025-03-25 01:05:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02274563
Frequency0.5
Structure
Chemical FormulaC3H3NO2
Molecular Mass85.0164
SMILESNC(=C=O)C=O
InChI KeyIBRRJTMCNAAHOU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ynolates
Direct Parent ynolates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • aldehyde
  • organic oxide
  • ynolate
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound