Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:04:38 UTC
Update Date2025-03-21 18:28:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00073268
Frequency40.7
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCC1(C)COC(=O)OC1
InChI KeyJRFXQKZEGILCCO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,3-dioxanes
Direct Parent 1,3-dioxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonic acid diesters
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • carbonyl group
  • organic oxide
  • carbonic acid derivative
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • carbonic acid diester
  • hydrocarbon derivative
  • meta-dioxane
  • organooxygen compound