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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:18 UTC
Update Date2025-03-25 00:46:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156484
Frequency0.5
Structure
Chemical FormulaC16H18O2
Molecular Mass242.1307
SMILESCc1c(C)c2cc3c(cc2oc1=O)C(C)CCC3
InChI KeyAJVTYVXCJPUEFZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classnaphthopyrans
Subclass naphthopyrans
Direct Parent naphthopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzopyrans
  • coumarins and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactones
  • naphthalenes
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • pyranones and derivatives
  • tetralins
  • Substituents
  • tetralin
  • benzopyran
  • 1-benzopyran
  • heteroaromatic compound
  • coumarin
  • lactone
  • oxacycle
  • naphthopyran
  • organic oxide
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyran
  • pyranone
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound