Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:14:10 UTC
Update Date2025-03-25 01:46:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02512177
Frequency0.5
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCC=CC1=C(C)C(O)CC1
InChI KeyHWCAEQMKTGOHMP-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