Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:12:47 UTC
Update Date2025-03-24 20:13:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01378065
Frequency0.9
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESOCC1OC2CC1CO2
InChI KeyKGDNMNWSFMWCNI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,3-dioxanes
Direct Parent 1,3-dioxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • primary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • acetal
  • tetrahydrofuran
  • hydrocarbon derivative
  • primary alcohol
  • meta-dioxane
  • organooxygen compound