Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:23:51 UTC
Update Date2025-03-24 22:03:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01975893
Frequency0.6
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCC(O)CC1=CCCC=C1
InChI KeyFLKZEWNDTSFABL-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