Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:23 UTC
Update Date2025-03-25 00:49:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177111
Frequency0.5
Structure
Chemical FormulaC13H16O2
Molecular Mass204.115
SMILESCOc1ccc2c(c1)OC(C)(C)C=C2C
InChI KeyZTXLMYTWNWBAEX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent precocenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • phenol ether
  • ether
  • alkyl aryl ether
  • precocene
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound