Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:40:23 UTC
Update Date2025-03-21 17:58:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00016222
Frequency264.0
Structure
Chemical FormulaC9H10O2
Molecular Mass150.0681
SMILESCOc1cccc(CC=O)c1
InChI KeyDELKCHMCSIXEHO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetaldehydes
Direct Parent phenylacetaldehydes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • alpha-hydrogen aldehydes
  • anisoles
  • hydrocarbon derivatives
  • methoxybenzenes
  • organic oxides
  • phenoxy compounds
  • Substituents
  • phenol ether
  • carbonyl group
  • ether
  • aldehyde
  • alkyl aryl ether
  • methoxybenzene
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • alpha-hydrogen aldehyde
  • anisole
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound
  • phenylacetaldehyde