Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:03:02 UTC
Update Date2025-03-21 18:07:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00069412
Frequency43.5
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESC=CC1(O)CCC(C)CC1
InChI KeyBZBLEYGVQKFOTN-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