Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:05:40 UTC
Update Date2025-03-24 22:29:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01216817
Frequency1.1
Structure
Chemical FormulaC7H13NO2
Molecular Mass143.0946
SMILESCC(C)=NCCCC(=O)O
InChI KeyPQARLPSEKYYUDE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • fatty acids and conjugates
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary ketimines
  • Substituents
  • aliphatic acyclic compound
  • ketimine
  • carbonyl group
  • carboxylic acid
  • gamma amino acid or derivatives
  • imine
  • fatty acid
  • 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
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound