Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:38:45 UTC
Update Date2025-03-21 17:58:09 UTC
HMDB IDHMDB0303236
Metabolite Identification
DeepMet IDDMID00012582
Name2-Hydroxy-5-methyl-3-hexanone
Frequency360.1
Structure
Chemical FormulaC7H14O2
Molecular Mass130.0994
SMILESCC(C)CC(=O)C(C)O
InChI KeyOYUBDGVWESFPBQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent acyloins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha-hydroxy ketones
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • ketone
  • alcohol
  • aliphatic acyclic compound
  • organic oxide
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative
  • alpha-hydroxy ketone