Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:47:29 UTC
Update Date2025-03-21 20:03:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00313600
Frequency6.2
Structure
Chemical FormulaC5H10O2
Molecular Mass102.0681
SMILESCC=CC(C)(O)O
InChI KeyJWFFKXXEGITGQB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent carbonyl hydrates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl hydrate
  • hydrocarbon derivative