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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:40:13 UTC
Update Date2025-03-21 17:58:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00015873
Frequency271.7
Structure
Chemical FormulaC7H15NO6
Molecular Mass209.0899
SMILESNCC1(O)C(O)C(O)C(O)C(O)C1O
InChI KeyHAGLMFZSCBOBRY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclitols and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary alcohols
    • Substituents
  • cyclohexanol
  • cyclitol or derivatives
  • cyclic alcohol
  • tertiary alcohol
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound