Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:41 UTC
Update Date2025-03-25 00:49:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177809
Frequency0.5
Structure
Chemical FormulaC11H12O2
Molecular Mass176.0837
SMILESCc1ccc(C)c2c1CCOC2=O
InChI KeyDYUNWWFPLSHLNS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 2-benzopyrans
Direct Parent 2-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • benzenoids
  • carboxylic acid esters
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • carboxylic acid derivative
  • lactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • carboxylic acid ester
  • 2-benzopyran
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound