Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:57:17 UTC
Update Date2025-03-25 01:38:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02472668
Frequency0.5
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESC=C1CCCC(C)(O)C1O
InChI KeyYERMHBORBIGBGF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • tertiary alcohol
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic alcohol
  • 1,2-diol