Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:23 UTC
Update Date2025-03-21 18:41:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134935
Frequency18.6
Structure
Chemical FormulaC10H12O3
Molecular Mass180.0786
SMILESCC1(O)COc2cc(O)ccc2C1
InChI KeyVZJNSLHWVFKTHK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent 1-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • benzenoids
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tertiary alcohols
  • Substituents
  • alcohol
  • ether
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • oxacycle
  • tertiary alcohol
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound