Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:18:55 UTC
Update Date2025-03-21 23:13:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00671757
Frequency2.3
Structure
Chemical FormulaC4H8O2
Molecular Mass88.0524
SMILESOCC1(O)CC1
InChI KeyNAQUXQVIOQVIKV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • Substituents
  • tertiary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclopropanol
  • 1,2-diol