Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:08:12 UTC
Update Date2025-03-24 20:37:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01509400
Frequency0.8
Structure
Chemical FormulaC6H11NO3
Molecular Mass145.0739
SMILESNC1CC(=O)C(O)C(O)C1
InChI KeyHFKIDRPUUOGXQQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • cyclic ketones
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • carbonyl group
  • cyclic ketone
  • cyclic alcohol
  • ketone
  • organic oxide
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,2-diol