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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:19 UTC
Update Date2025-03-25 00:46:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156525
Frequency0.5
Structure
Chemical FormulaC19H30O
Molecular Mass274.2297
SMILESCc1c(C)c(C)c2c(c1C)OC(C)(C)C(C)CC2(C)C
InChI KeySRKHFSBVLQMSGU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzoxepines
Subclass benzoxepines
Direct Parent benzoxepines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • benzenoids
  • hydrocarbon derivatives
  • oxacyclic compounds
    • Substituents
  • oxacycle
  • ether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • benzoxepine
  • hydrocarbon derivative
  • benzenoid
  • alkyl aryl ether
  • organooxygen compound