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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:10:58 UTC
Update Date2025-03-24 19:56:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01083583
Frequency1.3
Structure
Chemical FormulaC5H13NO3
Molecular Mass135.0895
SMILESCNCC(O)CC(O)O
InChI KeyBXKAPMCRAQFXSA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl hydrates
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
    • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl hydrate
  • secondary amine
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine