Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:24 UTC
Update Date2025-03-25 01:00:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245741
Frequency0.5
Structure
Chemical FormulaC6H12O2
Molecular Mass116.0837
SMILESCC1CC1C(O)CO
InChI KeyPGGFZALTLSAMBC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent 1,2-diols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • primary alcohols
  • secondary alcohols
  • Substituents
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • primary alcohol
  • 1,2-diol