Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:07:46 UTC
Update Date2025-03-24 14:12:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00789171
Frequency1.9
Structure
Chemical FormulaC6H11NO3
Molecular Mass145.0739
SMILESCN(C)C1C(=O)OCC1O
InChI KeyUFYWLFSGLUJTNM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid esters
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acid esters
  • gamma butyrolactones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • trialkylamines
  • Substituents
  • carbonyl group
  • monosaccharide
  • lactone
  • saccharide
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • tertiary amine
  • organoheterocyclic compound
  • alcohol
  • alpha-amino acid ester
  • tetrahydrofuran
  • tertiary aliphatic amine
  • gamma butyrolactone
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound