Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:25 UTC
Update Date2025-03-25 00:51:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02186287
Frequency0.5
Structure
Chemical FormulaC7H15NO4
Molecular Mass177.1001
SMILESNCC1C(O)C(O)CC(O)C1O
InChI KeyFVEANKYNWRLWQC-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
  • Substituents
  • cyclohexanol
  • cyclitol or derivatives
  • cyclic alcohol
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound