Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:35:48 UTC
Update Date2025-03-21 22:51:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00570333
Frequency2.9
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCCC1=C(C)C=CC(O)C1
InChI KeyWERXOHNHQDJUNA-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