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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:13 UTC
Update Date2025-03-25 01:00:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245296
Frequency0.5
Structure
Chemical FormulaC24H40O3
Molecular Mass376.2977
SMILESCCCCCCCCCCCCCCCCCc1cc(O)c2c(c1)OCO2
InChI KeyIKHKDVVIKULQPV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodioxoles
Subclass benzodioxoles
Direct Parent benzodioxoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acetals
  • benzenoids
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
    • Substituents
  • oxacycle
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • hydrocarbon derivative
  • benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • organooxygen compound
  • benzodioxole