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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:21 UTC
Update Date2025-03-21 18:39:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00125482
Frequency20.4
Structure
Chemical FormulaC6H15NO2
Molecular Mass133.1103
SMILESCC(C)C(O)C(O)CN
InChI KeyDIGQKVMRVIZGGL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent 1,2-diols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
    • Substituents
  • aliphatic acyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,2-diol