Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:45 UTC
Update Date2025-03-25 01:01:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251114
Frequency0.5
Structure
Chemical FormulaC8H12O4
Molecular Mass172.0736
SMILESOC1CC2OC=CC2(O)CC1O
InChI KeyZXBNIOGORLXXCU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrofurans
Subclass dihydrofurans
Direct Parent dihydrofurans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • tertiary alcohols
  • Substituents
  • alcohol
  • aliphatic heteropolycyclic compound
  • oxacycle
  • tertiary alcohol
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • cyclic alcohol
  • organooxygen compound
  • dihydrofuran