Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:33 UTC
Update Date2025-03-25 00:52:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02195612
Frequency0.5
Structure
Chemical FormulaC10H10O4
Molecular Mass194.0579
SMILESCC1OCc2cc(O)cc(O)c2C1=O
InChI KeyNRXJTPCGECMOFE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 2-benzopyrans
Direct Parent 2-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aryl alkyl ketones
  • benzenoids
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • vinylogous acids
  • Substituents
  • ether
  • aryl alkyl ketone
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • dialkyl ether
  • ketone
  • oxacycle
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • 2-benzopyran
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aryl ketone