Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:34:24 UTC
Update Date2025-03-21 17:56:36 UTC
HMDB IDHMDB0246464
Metabolite Identification
DeepMet IDDMID00002416
Name4-Hydroxypentan-2-one
Frequency2522.3
Structure
Chemical FormulaC5H10O2
Molecular Mass102.0681
SMILESCC(=O)CC(C)O
InChI KeyPCYZZYAEGNVNMH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-hydroxy ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • organic oxide
  • secondary alcohol
  • hydrocarbon derivative