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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:50:01 UTC
Update Date2025-03-21 22:58:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00604428
Frequency2.7
Structure
Chemical FormulaC9H12O
Molecular Mass136.0888
SMILESC=C1C=C(C)C(C)=C(C)O1
InChI KeyOTHNVRLUICYMPW-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