Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:40:22 UTC
Update Date2025-03-25 00:22:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01300439
Frequency1.0
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC1CC=CC(O)(CO)C1
InChI KeyHOHQIYVBWVGMAW-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
  • hydrocarbon derivatives
  • Substituents
  • tertiary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • 1,2-diol