Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:54 UTC
Update Date2025-03-21 18:40:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00131591
Frequency19.2
Structure
Chemical FormulaC13H18O
Molecular Mass190.1358
SMILESCCCC(O)=CCCc1ccccc1
InChI KeyMAJYHDUNSLWDEV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound