Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:53:08 UTC
Update Date2025-03-25 00:29:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02045761
Frequency0.6
Structure
Chemical FormulaC8H16O2
Molecular Mass144.115
SMILESC=CC(C)(O)C(C)(O)CC
InChI KeyVWLZGPYLAMHPOV-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