Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:52:44 UTC
Update Date2025-03-21 18:03:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00045128
Frequency74.7
Structure
Chemical FormulaC9H20O
Molecular Mass144.1514
SMILESCCC(C)(C)CC(C)(C)O
InChI KeyQMEHJTXRYVSFES-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