Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:22:04 UTC
Update Date2025-03-21 22:16:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00537484
Frequency3.1
Structure
Chemical FormulaC6H8O3
Molecular Mass128.0473
SMILESOC1C=CC2COC1O2
InChI KeyLPADRPJZOJHCDL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyrans
Direct Parent pyrans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • acetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic heteropolycyclic compound
  • oxacycle
  • meta-dioxolane
  • organic oxygen compound
  • acetal
  • pyran
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound