Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:46 UTC
Update Date2025-03-21 17:57:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00010290
Frequency460.7
Structure
Chemical FormulaC9H12O
Molecular Mass136.0888
SMILESCC(C)c1cccc(O)c1
InChI KeyVLJSLTNSFSOYQR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass cumenes
Direct Parent cumenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • organooxygen compounds
  • phenylpropanes
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • phenol
  • cumene
  • hydrocarbon derivative
  • 1-hydroxy-4-unsubstituted benzenoid
  • organooxygen compound