Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:23:24 UTC
Update Date2025-03-25 01:02:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02254787
Frequency0.5
Structure
Chemical FormulaC9H16O2
Molecular Mass156.115
SMILESCC1=CCC(O)C(O)C1(C)C
InChI KeyKAIWDAKTPSBNQF-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
  • secondary alcohols
  • Substituents
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • 1,2-diol