Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:55:39 UTC
Update Date2025-03-24 21:50:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01909143
Frequency0.6
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCC1=CCC(C(C)O)C=C1
InChI KeyVALSWPFMWDERNJ-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