Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:57:49 UTC
Update Date2025-03-21 18:05:26 UTC
HMDB IDHMDB0302233
Metabolite Identification
DeepMet IDDMID00056990
Name3,6-Dimethylcoumaran
Frequency55.8
Structure
Chemical FormulaC10H12O
Molecular Mass148.0888
SMILESCc1ccc2c(c1)OCC2C
InChI KeyNUGFZCHRZRZHLK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classcoumarans
Subclass coumarans
Direct Parent coumarans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • benzenoids
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • ether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • alkyl aryl ether
  • coumaran
  • organooxygen compound