Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:58:17 UTC
Update Date2025-03-24 16:35:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00910121
Frequency1.6
Structure
Chemical FormulaC9H18O
Molecular Mass142.1358
SMILESCC(C)=CC(C)(O)C(C)C
InChI KeyCVMZUYQSQYOMBW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • hydrocarbon derivative