Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:08 UTC
Update Date2025-03-21 18:38:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00120270
Frequency21.6
Structure
Chemical FormulaC4H7NO2
Molecular Mass101.0477
SMILESO=C1CNCCO1
InChI KeyZQHJAAMMKABEBS-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
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • dialkylamines
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • morpholines
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • lactone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • secondary aliphatic amine
  • alpha-amino acid ester
  • azacycle
  • secondary amine
  • oxazinane
  • oxacycle
  • morpholine
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine