Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:40:29 UTC
Update Date2025-03-21 17:58:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00016441
Frequency259.9
Structure
Chemical FormulaC7H14O2
Molecular Mass130.0994
SMILESCC1(O)CCCC(O)C1
InChI KeyJXONSAWSOYXJMA-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
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • tertiary alcohols
  • Substituents
  • tertiary alcohol
  • cyclohexanol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic alcohol