Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:32 UTC
Update Date2025-03-25 00:55:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02214145
Frequency0.5
Structure
Chemical FormulaC12H18O
Molecular Mass178.1358
SMILESCCCCc1c(C)ccc(C)c1O
InChI KeyOZJLZDNVMYCBBD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass xylenes
Direct Parent p-xylenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • meta cresols
  • organooxygen compounds
  • ortho cresols
  • p-xylenes
  • Substituents
  • m-cresol
  • 1-hydroxy-4-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • p-xylene
  • organic oxygen compound
  • o-cresol
  • p-xylenol
  • phenol
  • hydrocarbon derivative
  • organooxygen compound