Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:08:48 UTC
Update Date2025-03-24 20:37:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01510898
Frequency0.8
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCC1(O)CC2C=CC1CC2
InChI KeyBGXFVZFLEKMHES-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
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • Substituents
  • tertiary alcohol
  • hydrocarbon derivative
  • cyclic alcohol
  • aliphatic homopolycyclic compound