Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:09:03 UTC
Update Date2025-03-21 23:09:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00648769
Frequency2.4
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCC1=C(O)C(O)C(=O)C1C
InChI KeyYZHFQKAUOKJARN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • ketone
  • carbonyl group
  • organic oxide
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic ketone