Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:48:50 UTC
Update Date2025-03-24 17:58:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01031415
Frequency1.4
Structure
Chemical FormulaC7H8O
Molecular Mass108.0575
SMILESC=C1C=COC(C)=C1
InChI KeyPTKRKCNUPBZOIN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyrans
Direct Parent pyrans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • organic oxygen compound
  • pyran
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound