Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:59:37 UTC
Update Date2025-03-21 18:06:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00061308
Frequency50.8
Structure
Chemical FormulaC4H10O3
Molecular Mass106.063
SMILESCC(O)C(C)(O)O
InChI KeyHEKKFLZQKWPFJB-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
  • carbonyl hydrates
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • carbonyl hydrate
  • secondary alcohol
  • hydrocarbon derivative