Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:57:42 UTC
Update Date2025-03-24 19:49:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01052647
Frequency1.3
Structure
Chemical FormulaC3H3NO2
Molecular Mass85.0164
SMILESN=CC(O)=C=O
InChI KeyVTBBRPKOIMLSIK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ynolates
Direct Parent ynolates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • ynolate
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound