Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:18:29 UTC
Update Date2025-03-21 19:10:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00247195
Frequency8.5
Structure
Chemical FormulaC8H14O
Molecular Mass126.1045
SMILESCC1=CCC(C)C(O)C1
InChI KeyJVQIDQBRIXEHMG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative