Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:27:33 UTC
Update Date2025-03-21 23:17:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00692405
Frequency2.2
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCC1=CC=C(C(C)O)CC1
InChI KeyXKEMLRCXRQRULF-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