Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:13 UTC
Update Date2025-03-25 00:46:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156291
Frequency0.5
Structure
Chemical FormulaC11H10O4
Molecular Mass206.0579
SMILESCC(=O)C1=C(O)Oc2ccccc2C1O
InChI KeyQOOPTQWXXABMEQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent 1-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • benzenoids
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • oxacyclic compounds
  • secondary alcohols
  • vinylogous acids
  • vinylogous esters
  • Substituents
  • alcohol
  • carbonyl group
  • 1-benzopyran
  • vinylogous ester
  • ketone
  • oxacycle
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound