Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:04:10 UTC
Update Date2025-03-24 21:54:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01929382
Frequency0.6
Structure
Chemical FormulaC6H12O2
Molecular Mass116.0837
SMILESOCCC(O)C1CC1
InChI KeyRNVDETXCIRALGP-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
  • hydrocarbon derivatives
  • Substituents
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative