Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:31:59 UTC
Update Date2025-03-24 13:57:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00703016
Frequency2.2
Structure
Chemical FormulaC5H11NO2
Molecular Mass117.079
SMILESCNCCC(=O)OC
InChI KeyNGNUXOCKVMKGQL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • dialkylamines
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl group
  • secondary amine
  • beta amino acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine