Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:10 UTC
Update Date2025-03-25 01:00:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02242781
Frequency0.5
Structure
Chemical FormulaC9H16O5
Molecular Mass204.0998
SMILESCC(=O)C1(O)CC(O)C(C(C)(C)O)O1
InChI KeyULTKNFFMEHKODM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hemiacetals
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • oxacyclic compounds
  • secondary alcohols
  • tertiary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • carbonyl group
  • tetrahydrofuran
  • monosaccharide
  • ketone
  • oxacycle
  • tertiary alcohol
  • organic oxide
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • organoheterocyclic compound