Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:50:58 UTC
Update Date2025-03-24 14:04:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00748907
Frequency2.0
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCC1(C)OCC(C=O)O1
InChI KeyYSGPYVWACGYQDJ-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-dioxolanes
  • aldehydes
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • meta-dioxolane
  • carbonyl group
  • aldehyde
  • oxacycle
  • organic oxide
  • ketal
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound