Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:48 UTC
Update Date2025-03-25 00:45:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150691
Frequency0.5
Structure
Chemical FormulaC9H14O2S
Molecular Mass186.0715
SMILESCOCCc1ccc(CCO)s1
InChI KeyAHXBCMFWKHSAJC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiophenes
Subclass 2,5-disubstituted thiophenes
Direct Parent 2,5-disubstituted thiophenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • dialkyl ethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • Substituents
  • 2,5-disubstituted thiophene
  • alcohol
  • ether
  • organic oxygen compound
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound