Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:07:51 UTC
Update Date2025-03-24 16:40:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00933227
Frequency1.5
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCC1(C)OCC(=O)CO1
InChI KeyASFQDNDZFGFMMP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxanes
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • cyclic ketone
  • ketone
  • oxacycle
  • organic oxide
  • ketal
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • meta-dioxane
  • organoheterocyclic compound