Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:49 UTC
Update Date2025-03-25 00:59:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02235206
Frequency0.5
Structure
Chemical FormulaC13H16O2
Molecular Mass204.115
SMILESCc1cc2c(cc1C)OC(C)(C)C(=O)C2
InChI KeyVBOVXJMMVINAAB-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
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • ether
  • 2,2-dimethyl-1-benzopyran
  • cyclic ketone
  • alkyl aryl ether
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound