Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:44 UTC
Update Date2025-03-25 00:58:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02228210
Frequency0.5
Structure
Chemical FormulaC9H16O3
Molecular Mass172.1099
SMILESC=CC1(C)CC(C)C(O)(CO)O1
InChI KeyBXUPNCJXNCGUBP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • hemiacetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • alcohol
  • oxacycle
  • organic oxygen compound
  • tetrahydrofuran
  • aliphatic heteromonocyclic compound
  • hemiacetal
  • hydrocarbon derivative
  • organooxygen compound