Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:05:34 UTC
Update Date2025-03-21 19:03:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00217256
Frequency10.0
Structure
Chemical FormulaC7H11NO2
Molecular Mass141.079
SMILESO=C(O)CN=C1CCCC1
InChI KeyWYAQCUGLVMZNRP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary ketimines
  • Substituents
  • ketimine
  • carbonyl group
  • carboxylic acid
  • imine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • secondary ketimine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound