Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:28 UTC
Update Date2025-03-21 18:34:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00101644
Frequency26.8
Structure
Chemical FormulaC10H14N2O2
Molecular Mass194.1055
SMILESNCC(O)=NC(O)Cc1ccccc1
InChI KeyJEYVOWIBVHIBMY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkanolamines
  • carboximidic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • carboximidic acid
  • monocyclic benzene moiety
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • alkanolamine