Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:03 UTC
Update Date2025-03-25 00:48:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169404
Frequency0.5
Structure
Chemical FormulaC12H20OS
Molecular Mass212.1235
SMILESCCCCCCCc1scc(O)c1C
InChI KeyPYUVOUVKGMQLTJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • thiophenes
  • Substituents
  • organic oxygen compound
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • hydrocarbon derivative
  • thiophene
  • organooxygen compound