Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:40:05 UTC
Update Date2025-03-24 14:00:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00722823
Frequency2.1
Structure
Chemical FormulaC6H12O2
Molecular Mass116.0837
SMILESCCC1OCC(C)O1
InChI KeyCSZCLQLJVFLXLI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxolanes
Subclass 1,3-dioxolanes
Direct Parent 1,3-dioxolanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • meta-dioxolane
  • organic oxygen compound
  • acetal
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound