Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:18:41 UTC
Update Date2025-03-25 00:14:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01248999
Frequency1.1
Structure
Chemical FormulaC9H12O
Molecular Mass136.0888
SMILESCC1(C)OC2C=CC=CC21
InChI KeyKJXPBZJRJFSUAB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxetanes
Subclass oxetanes
Direct Parent oxetanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • ether
  • organic oxygen compound
  • oxetane
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound