Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:24:57 UTC
Update Date2025-03-21 22:18:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00544517
Frequency3.1
Structure
Chemical FormulaC8H14O
Molecular Mass126.1045
SMILESCCC=C=CC(C)(C)O
InChI KeyLJCGIWHYJKOVDI-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