Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:12:46 UTC
Update Date2025-03-24 19:57:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01088081
Frequency1.3
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCCC1CC=C(C)C(O)C1
InChI KeyXETAZLRBUZWCAS-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