Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:47 UTC
Update Date2025-03-21 18:40:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00131336
Frequency19.3
Structure
Chemical FormulaC13H18O
Molecular Mass190.1358
SMILESCc1ccc(C)c2c1CC(C)(C)CO2
InChI KeyJEHDMENOAHZHED-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent 1-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • benzenoids
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • ether
  • 1-benzopyran
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound