Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:28:27 UTC
Update Date2025-03-25 00:42:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02129119
Frequency0.6
Structure
Chemical FormulaC7H14O2
Molecular Mass130.0994
SMILESCC=CC(O)(CC)CO
InChI KeyFKJTVGQNOGGADW-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
  • 1,2-diols
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • hydrocarbon derivative
  • 1,2-diol