Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:17:46 UTC
Update Date2025-03-21 20:52:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00384803
Frequency4.8
Structure
Chemical FormulaC7H8O3
Molecular Mass140.0473
SMILESCOCc1ccc(C=O)o1
InChI KeyASHVULSQMDWKFO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent aryl-aldehydes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • furan
  • ether
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • dialkyl ether
  • oxacycle
  • organic oxide
  • aryl-aldehyde
  • hydrocarbon derivative
  • organoheterocyclic compound