Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:14 UTC
Update Date2025-03-25 00:51:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02185861
Frequency0.5
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESO=C(CO)CCC1CC1
InChI KeyOEYJRRQSEBSGKI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • alpha-hydroxy ketones
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • ketone
  • alcohol
  • carbonyl group
  • organic oxide
  • aliphatic homomonocyclic compound
  • monosaccharide
  • hydrocarbon derivative
  • alpha-hydroxy ketone