Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:56:00 UTC
Update Date2025-03-24 20:06:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01337850
Frequency1.0
Structure
Chemical FormulaC6H12O3
Molecular Mass132.0786
SMILESCC1(C)OCCC(O)O1
InChI KeyVVNWGMADQIFKOH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxanes
  • hemiacetals
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • ketal
  • aliphatic heteromonocyclic compound
  • hemiacetal
  • hydrocarbon derivative
  • meta-dioxane
  • organoheterocyclic compound