Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:42 UTC
Update Date2025-03-21 18:35:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107178
Frequency25.1
Structure
Chemical FormulaC10H15NO3
Molecular Mass197.1052
SMILESCCC=CCCC(O)=NCC(O)=C=O
InChI KeyKTJSPVFSCLNHLK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboximidic acids and derivatives
Subclass carboximidic acids
Direct Parent carboximidic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkanolamines
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • ynolates
  • Substituents
  • aliphatic acyclic compound
  • carboximidic acid
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • ynolate
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • alkanolamine