Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:06:51 UTC
Update Date2025-03-21 18:29:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00078651
Frequency37.2
Structure
Chemical FormulaC10H8O2S
Molecular Mass192.0245
SMILESO=C(O)Cc1csc2ccccc12
InChI KeyVFZQJKXVHYZXMM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzothiophenes
Subclass 1-benzothiophenes
Direct Parent 1-benzothiophenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • benzenoids
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • thiophenes
  • Substituents
  • carbonyl group
  • carboxylic acid
  • heteroaromatic compound
  • thiophene
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • 1-benzothiophene
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound