Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:19:32 UTC
Update Date2025-03-21 22:15:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00531448
Frequency3.2
Structure
Chemical FormulaC5H10O4
Molecular Mass134.0579
SMILESOCC1COCC(O)O1
InChI KeyJQMFPKCSCDSYNA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,4-dioxanes
Direct Parent 1,4-dioxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hemiacetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • primary alcohols
  • Substituents
  • alcohol
  • ether
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • para-dioxane
  • aliphatic heteromonocyclic compound
  • hemiacetal
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound