Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:34:19 UTC
Update Date2025-03-24 21:14:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01716427
Frequency0.7
Structure
Chemical FormulaC6H11NO3
Molecular Mass145.0739
SMILESCCOC(=O)C(=O)N(C)C
InChI KeyHMALWDVRMHVUAW-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 acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary carboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxamide group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound