Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:37:33 UTC
Update Date2025-03-24 21:15:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01724352
Frequency0.7
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCCCC1=CCCC(O)C1
InChI KeyJPGSPMROQDVULS-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