Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:05:51 UTC
Update Date2025-03-24 21:55:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01933337
Frequency0.6
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESC=CCC=CC(C)(O)CC
InChI KeyGOWCALBPKDXVAC-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