Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:56:16 UTC
Update Date2025-03-24 21:24:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01768837
Frequency0.7
Structure
Chemical FormulaC7H8O
Molecular Mass108.0575
SMILESC1=CC23CC1CC2O3
InChI KeyMMGISPUVXMVZLH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • ether
  • organic oxygen compound
  • oxirane
  • hydrocarbon derivative
  • oxane
  • dialkyl ether
  • organooxygen compound