Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:46:54 UTC
Update Date2025-03-21 18:01:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00031089
Frequency118.9
Structure
Chemical FormulaC4H8O2
Molecular Mass88.0524
SMILESC=C(O)C(C)O
InChI KeyWTLYWPNEAZECAM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • secondary alcohol
  • hydrocarbon derivative