Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:57:57 UTC
Update Date2025-03-25 01:39:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02474285
Frequency0.5
Structure
Chemical FormulaC9H12O
Molecular Mass136.0888
SMILESC=CC1(O)C=CC2CC1C2
InChI KeyJCHFITCISNOFPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • tertiary alcohol
  • hydrocarbon derivative
  • aliphatic homopolycyclic compound