Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:13:43 UTC
Update Date2025-03-21 18:33:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00094893
Frequency29.3
Structure
Chemical FormulaC7H14O4
Molecular Mass162.0892
SMILESCC1(C)OCC(O)C(O)C1O
InChI KeyKJJKNRTZJJIGEK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • Substituents
  • alcohol
  • ether
  • monosaccharide
  • dialkyl ether
  • oxacycle
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • organoheterocyclic compound