Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:51 UTC
Update Date2025-03-21 17:58:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00012835
Frequency352.4
Structure
Chemical FormulaC6H13NO2
Molecular Mass131.0946
SMILESCC(=O)OCCN(C)C
InChI KeyGOLSFPMYASLXJC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent carboxylic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amino acids and derivatives
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • amino acid or derivatives
  • tertiary aliphatic amine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound