Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:50 UTC
Update Date2025-03-25 00:52:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02196241
Frequency0.5
Structure
Chemical FormulaC9H16O2
Molecular Mass156.115
SMILESCC1=CCC(C)(C)C(O)C1O
InChI KeyRGDAZRZMUPABKO-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