Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:28:04 UTC
Update Date2025-03-24 21:11:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01701490
Frequency0.7
Structure
Chemical FormulaC6H11NO3
Molecular Mass145.0739
SMILESNC(CCCO)C(O)=C=O
InChI KeyYEVQGXHGBITIAN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ynolates
Direct Parent ynolates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic oxide
  • ynolate
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound