Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:39 UTC
Update Date2025-03-25 00:46:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155021
Frequency0.5
Structure
Chemical FormulaC11H12O3
Molecular Mass192.0786
SMILESCc1ccc(C)c2c1CC(=O)C(O)O2
InChI KeyGXFUERXZRDRSOF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent 1-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • benzenoids
  • cyclic ketones
  • hemiacetals
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • 1-benzopyran
  • cyclic ketone
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hemiacetal
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound