Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:12 UTC
Update Date2025-03-25 00:57:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02227049
Frequency0.5
Structure
Chemical FormulaC8H10O2S
Molecular Mass170.0402
SMILESCC(C)c1sccc1C(=O)O
InChI KeyFUFUJSNKJONXRX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiophenes
Subclass thiophene carboxylic acids and derivatives
Direct Parent thiophene carboxylic acids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • Substituents
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • thiophene carboxylic acid
  • heteroaromatic compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound