Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:17:04 UTC
Update Date2025-03-24 23:36:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01245066
Frequency1.1
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESCC1CCC2(CCO2)O1
InChI KeyNWXZFBRDNYGISV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • oxetanes
  • tetrahydrofurans
  • Substituents
  • oxacycle
  • tetrahydrofuran
  • ketal
  • oxetane
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound