Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:02:27 UTC
Update Date2025-03-21 18:07:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00068012
Frequency44.6
Structure
Chemical FormulaC13H16O
Molecular Mass188.1201
SMILESCc1cc(C)c2c(c1)OC(C)(C)C=C2
InChI KeyXZTNHYHSTPXJMV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent 2,2-dimethyl-1-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • benzenoids
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • ether
  • 2,2-dimethyl-1-benzopyran
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound