Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:40 UTC
Update Date2025-03-25 00:47:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02163962
Frequency0.5
Structure
Chemical FormulaC9H16O2
Molecular Mass156.115
SMILESCC1=CC(O)CC(O)C1(C)C
InChI KeyVUCREOXMLYXIGT-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