Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:23:20 UTC
Update Date2025-03-21 19:13:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00258317
Frequency8.0
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESC=CC(O)C1=C(C)CCC1
InChI KeyMKJHOCMYRGMXDC-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