Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:25:52 UTC
Update Date2025-03-21 22:18:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00546586
Frequency3.0
Structure
Chemical FormulaC6H10O2
Molecular Mass114.0681
SMILESCC(=CC=O)C(C)O
InChI KeyUYWOYCXMTYGYRB-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
  • aldehydes
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • secondary alcohol
  • aldehyde
  • hydrocarbon derivative