Hmdb loader

Showing information for DMID00136460

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:03 UTC
Update Date2025-03-21 18:41:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00136460
Frequency18.4
Structure
Chemical FormulaC10H9O4+
Molecular Mass193.0495
SMILESCOc1c[o+]c2cc(O)cc(O)c2c1
InChI KeySCBVMAGDJBWWEM-UHFFFAOYSA-O
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
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkyl aryl ethers
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic cations
  • oxacyclic compounds
    • Substituents
  • ether
  • 1-benzopyran
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • organic cation
  • organooxygen compound