Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:03 UTC
Update Date2025-03-21 18:40:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129572
Frequency19.6
Structure
Chemical FormulaC10H10O4
Molecular Mass194.0579
SMILESCOc1ccc2c(c1)OCC(O)C2=O
InChI KeyKNOPJJJMLFXIKJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent chromones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • aryl alkyl ketones
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • phenol ether
  • ether
  • aryl alkyl ketone
  • alkyl aryl ether
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • chromone
  • aromatic heteropolycyclic compound
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aryl ketone