Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:24:11 UTC
Update Date2025-03-24 20:18:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01404868
Frequency0.9
Structure
Chemical FormulaC7H14O2
Molecular Mass130.0994
SMILESCC1OCC(C)(C)CO1
InChI KeyWKHMCZHHXYIWCS-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
  • acetals
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • organic oxygen compound
  • acetal
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • meta-dioxane
  • organooxygen compound