Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:58:23 UTC
Update Date2025-03-24 20:58:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01629691
Frequency0.8
Structure
Chemical FormulaC6H10O2
Molecular Mass114.0681
SMILESOC1=CCC(O)CC1
InChI KeyQFAGLPRKJJLLME-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