Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:31 UTC
Update Date2025-03-25 00:54:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02209330
Frequency0.5
Structure
Chemical FormulaC11H13ClO
Molecular Mass196.0655
SMILESCC1(C)CCc2cc(O)c(Cl)cc21
InChI KeyDNYNXTNUQNWJHI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanes
Direct Parent indanes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl chlorides
  • hydrocarbon derivatives
  • organochlorides
  • organooxygen compounds
  • Substituents
  • aryl chloride
  • organic oxygen compound
  • organochloride
  • indane
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • organohalogen compound
  • organooxygen compound
  • aryl halide