Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:11:48 UTC
Update Date2025-03-21 20:49:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00370716
Frequency5.0
Structure
Chemical FormulaC7H8O3
Molecular Mass140.0473
SMILESCc1occ(C(=O)O)c1C
InChI KeyLEWVTBWXAPXYCS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furoic acid and derivatives
Direct Parent furoic acids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • furan-3-carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • furan-3-carboxylic acid
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • carboxylic acid derivative
  • furoic acid
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • 1-carboxy-2-haloaromatic compound
  • furan-3-carboxylic acid or derivatives
  • organooxygen compound